Species Name |
Formula |
ΔfH°(0 K) |
ΔfH°(298.15 K) |
Uncertainty |
Units |
Relative Molecular Mass |
ATcT ID |
Hydrogen molecule | H2 (g) | 0 | 0 | exact | | 2.01588 ± 0.00014 | 1333-74-0*0 |
Oxygen molecule | O2 (g) | 0 | 0 | exact | | 31.99880 ± 0.00060 | 7782-44-7*0 |
Graphite | C (graphite) | 0 | 0 | exact | | 12.01070 ± 0.00080 | 7440-44-0*500 |
Nitrogen molecule | N2 (g) | 0 | 0 | exact | | 28.01348 ± 0.00014 | 7727-37-9*0 |
Fluorine molecule | F2 (g) | 0 | 0 | exact | | 37.9968064 ± 0.0000010 | 7782-41-4*0 |
Chlorine molecule | Cl2 (g) | 0 | 0 | exact | | 70.9054 ± 0.0018 | 7782-50-5*0 |
Bromine molecule | Br2 (cr,l) | 0 | 0 | exact | | 159.8080 ± 0.0020 | 7726-95-6*500 |
Iodine molecule | I2 (cr,l) | 0 | 0 | exact | | 253.808940 ± 0.000060 | 7553-56-2*500 |
Helium | He (g) | 0 | 0 | exact | | 4.0026020 ± 0.0000020 | 7440-59-7*0 |
Neon | Ne (g) | 0 | 0 | exact | | 20.17970 ± 0.00060 | 7440-01-9*0 |
Argon | Ar (g) | 0 | 0 | exact | | 39.9480 ± 0.0010 | 7440-37-1*0 |
Krypton | Kr (g) | 0 | 0 | exact | | 83.8000 ± 0.1000 | 7439-90-9*0 |
Xenon | Xe (g) | 0 | 0 | exact | | 131.2900 ± 0.0200 | 7440-63-3*0 |
Hydrogen atom | H (g) | 216.034 | 217.998 | ± 0.000 | kJ/mol | 1.007940 ± 0.000070 | 12385-13-6*0 |
Carbon atom | C (g) | 711.388 | 716.873 | ± 0.057 | kJ/mol | 12.01070 ± 0.00080 | 7440-44-0*0 |
Oxygen atom | O (g) | 246.844 | 249.229 | ± 0.002 | kJ/mol | 15.99940 ± 0.00030 | 17778-80-2*0 |
Nitrogen atom | N (g) | 470.573 | 472.435 | ± 0.024 | kJ/mol | 14.006740 ± 0.000070 | 17778-88-0*0 |
Carbon dioxide | CO2 (g) | -393.108 | -393.474 | ± 0.015 | kJ/mol | 44.0095 ± 0.0010 | 124-38-9*0 |
Fluorine atom | F (g) | 77.268 | 79.374 | ± 0.057 | kJ/mol | 18.99840320 ± 0.00000050 | 14762-94-8*0 |
Water | H2O (cr,l) | -286.297 | -285.825 | ± 0.027 | kJ/mol | 18.01528 ± 0.00033 | 7732-18-5*500 |
Methane | CH4 (g) | -66.564 | -74.534 | ± 0.057 | kJ/mol | 16.04246 ± 0.00085 | 74-82-8*0 |
Chlorine atom | Cl (g) | 119.621 | 121.302 | ± 0.002 | kJ/mol | 35.45270 ± 0.00090 | 22537-15-1*0 |
Bromine atom | Br (g) | 117.914 | 111.852 | ± 0.056 | kJ/mol | 79.9040 ± 0.0010 | 10097-32-2*0 |
Water | H2O (g) | -238.919 | -241.822 | ± 0.027 | kJ/mol | 18.01528 ± 0.00033 | 7732-18-5*0 |
Hydrogen atom cation | H+ (g) | 1528.084 | 1530.047 | ± 0.000 | kJ/mol | 1.007391 ± 0.000070 | 12408-02-5*0 |
Hydrogen chloride | HCl (g) | -91.989 | -92.173 | ± 0.006 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*0 |
Hydroxyl | OH (g) | 37.262 | 37.501 | ± 0.027 | kJ/mol | 17.00734 ± 0.00031 | 3352-57-6*0 |
Hydrogen bromide | HBr (g) | -28.01 | -35.85 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*0 |
Hydrogen fluoride | HF (g) | -272.664 | -272.711 | ± 0.057 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*0 |
Carbon monoxide | CO (g) | -113.805 | -110.525 | ± 0.026 | kJ/mol | 28.01010 ± 0.00085 | 630-08-0*0 |
Iodine atom | I (g) | 107.157 | 106.757 | ± 0.002 | kJ/mol | 126.904470 ± 0.000030 | 14362-44-8*0 |
Ethylene | C2H4 (g) | 61.07 | 52.56 | ± 0.15 | kJ/mol | 28.0532 ± 0.0016 | 74-85-1*0 |
Methanol | CH3OH (g) | -189.82 | -200.70 | ± 0.18 | kJ/mol | 32.04186 ± 0.00090 | 67-56-1*0 |
Ethane | C2H6 (g) | -68.12 | -83.78 | ± 0.17 | kJ/mol | 30.0690 ± 0.0017 | 74-84-0*0 |
Formaldehyde | H2CO (g) | -105.33 | -109.16 | ± 0.11 | kJ/mol | 30.02598 ± 0.00087 | 50-00-0*0 |
Acetylene | HCCH (g) | 228.88 | 228.32 | ± 0.15 | kJ/mol | 26.0373 ± 0.0016 | 74-86-2*0 |
Methyl chloride | CH3Cl (g) | -74.68 | -82.62 | ± 0.21 | kJ/mol | 50.4872 ± 0.0012 | 74-87-3*0 |
Ethanol | CH3CH2OH (g) | -216.85 | -234.57 | ± 0.22 | kJ/mol | 46.0684 ± 0.0017 | 64-17-5*0 |
Methyl radical | CH3 (g) | 149.880 | 146.494 | ± 0.081 | kJ/mol | 15.03452 ± 0.00083 | 2229-07-4*0 |
Ammonia | NH3 (g) | -38.565 | -45.558 | ± 0.030 | kJ/mol | 17.03056 ± 0.00022 | 7664-41-7*0 |
Nitric oxide | NO (g) | 90.585 | 91.089 | ± 0.064 | kJ/mol | 30.00614 ± 0.00031 | 10102-43-9*0 |
Methyl fluoride | CH3F (g) | -228.55 | -236.58 | ± 0.32 | kJ/mol | 34.03292 ± 0.00083 | 593-53-3*0 |
Hydrogen iodide | HI (g) | 28.645 | 26.470 | ± 0.036 | kJ/mol | 127.912410 ± 0.000076 | 10034-85-2*0 |
Methyl bromide | CH3Br (g) | -20.98 | -36.38 | ± 0.19 | kJ/mol | 94.9385 ± 0.0013 | 74-83-9*0 |
Hydrogen cyanide | HCN (g) | 129.675 | 129.291 | ± 0.095 | kJ/mol | 27.02538 ± 0.00081 | 74-90-8*0 |
Hydroxyde ion | [OH]- (g) | -139.080 | -139.047 | ± 0.027 | kJ/mol | 17.00789 ± 0.00031 | 14280-30-9*0 |
Nitrogen dioxide | ONO (g) | 36.824 | 34.017 | ± 0.064 | kJ/mol | 46.00554 ± 0.00060 | 10102-44-0*0 |
Tetrafluoromethane | CF4 (g) | -927.41 | -933.38 | ± 0.27 | kJ/mol | 88.00431 ± 0.00080 | 75-73-0*0 |
Fluoride | F- (g) | -250.897 | -249.112 | ± 0.057 | kJ/mol | 18.99895178 ± 0.00000050 | 16984-48-8*0 |
Hydrogen peroxide | H2O2 (g) | -129.452 | -135.442 | ± 0.064 | kJ/mol | 34.01468 ± 0.00062 | 7722-84-1*0 |
Hydroperoxo | HO2 (g) | 15.19 | 12.27 | ± 0.17 | kJ/mol | 33.00674 ± 0.00060 | 3170-83-0*0 |
Dibromine | Br2 (g) | 45.68 | 30.88 | ± 0.12 | kJ/mol | 159.8080 ± 0.0020 | 7726-95-6*0 |
Acetaldehyde | CH3CHO (g) | -154.90 | -165.37 | ± 0.32 | kJ/mol | 44.0526 ± 0.0017 | 75-07-0*0 |
Fluoroform | CF3H (g) | -688.90 | -695.85 | ± 0.56 | kJ/mol | 70.01385 ± 0.00080 | 75-46-7*0 |
Hypoflorous acid | HOF (g) | -84.36 | -87.26 | ± 0.19 | kJ/mol | 36.00574 ± 0.00031 | 14034-79-8*0 |
Hypochlorous acid | HOCl (g) | -73.865 | -76.805 | ± 0.028 | kJ/mol | 52.46004 ± 0.00095 | 7790-92-3*0 |
Hypobromous acid | HOBr (g) | -51.31 | -61.78 | ± 0.55 | kJ/mol | 96.9113 ± 0.0010 | 13517-11-8*0 |
Diiodine | I2 (g) | 65.497 | 62.417 | ± 0.004 | kJ/mol | 253.808940 ± 0.000060 | 7553-56-2*0 |
Methyl iodide | CH3I (g) | 24.49 | 14.96 | ± 0.17 | kJ/mol | 141.93899 ± 0.00083 | 74-88-4*0 |
Tetrachloromethane | CCl4 (g) | -95.42 | -97.59 | ± 0.75 | kJ/mol | 153.8215 ± 0.0037 | 56-23-5*0 |
Benzene | C6H6 (g) | 100.70 | 83.18 | ± 0.26 | kJ/mol | 78.1118 ± 0.0048 | 71-43-2*0 |
Trifluoromethyl | CF3 (g) | -465.40 | -468.19 | ± 0.59 | kJ/mol | 69.00591 ± 0.00080 | 2264-21-3*0 |
Ethyl | CH3CH2 (g) | 131.00 | 119.93 | ± 0.37 | kJ/mol | 29.0611 ± 0.0016 | 2025-56-1*0 |
Bromide | Br- (g) | -206.623 | -212.685 | ± 0.056 | kJ/mol | 79.9045 ± 0.0010 | 24959-67-9*0 |
Iodide | I- (g) | -187.995 | -188.396 | ± 0.002 | kJ/mol | 126.905019 ± 0.000030 | 20461-54-5*0 |
Difluorophosgene | COF2 (g) | -603.56 | -606.65 | ± 0.54 | kJ/mol | 66.00691 ± 0.00085 | 353-50-4*0 |
Cyanogen chloride | ClCN (g) | 135.01 | 135.74 | ± 0.45 | kJ/mol | 61.4701 ± 0.0012 | 506-77-4*0 |
Tetrabromomethane | CBr4 (g) | 131.7 | 102.0 | ± 1.1 | kJ/mol | 331.6267 ± 0.0041 | 558-13-4*0 |
Phenyl | C6H5 (g) | 350.57 | 337.29 | ± 0.59 | kJ/mol | 77.1039 ± 0.0048 | 2396-01-2*0 |
Hydroxymethyl | CH2OH (g) | -9.79 | -16.10 | ± 0.44 | kJ/mol | 31.03392 ± 0.00088 | 2597-43-5*0 |
Methylcarbonium | [CH3]+ (g) | 1099.286 | 1095.517 | ± 0.078 | kJ/mol | 15.03397 ± 0.00083 | 14531-53-4*0 |
Methoxide | [CH3O]- (g) | -122.25 | -130.24 | ± 0.37 | kJ/mol | 31.03447 ± 0.00088 | 3315-60-4*0 |
Formic acid | HC(O)OH (g, syn) | -371.19 | -378.51 | ± 0.25 | kJ/mol | 46.0254 ± 0.0010 | 64-18-6*1 |
Nitric acid | HNO3 (g) | -124.45 | -134.16 | ± 0.18 | kJ/mol | 63.01288 ± 0.00091 | 7697-37-2*0 |
Imidogen | NH (g) | 358.74 | 358.79 | ± 0.17 | kJ/mol | 15.014680 ± 0.000099 | 13774-92-0*0 |
Oxomethylium | [HCO]+ (g) | 827.83 | 827.24 | ± 0.11 | kJ/mol | 29.01749 ± 0.00086 | 17030-74-9*0 |
Methylidyne radical | CH (g) | 592.83 | 596.17 | ± 0.13 | kJ/mol | 13.01864 ± 0.00080 | 3315-37-5*0 |
Ozone | OOO (g) | 144.398 | 141.749 | ± 0.040 | kJ/mol | 47.99820 ± 0.00090 | 10028-15-6*0 |
Oxonium | [H3O]+ (g) | 605.74 | 598.75 | ± 0.61 | kJ/mol | 19.02267 ± 0.00037 | 13968-08-6*0 |
Allene | CH2CCH2 (g) | 197.65 | 190.16 | ± 0.36 | kJ/mol | 40.0639 ± 0.0024 | 463-49-0*0 |
Methylene radical | CH2 (g, singlet) | 428.62 | 429.04 | ± 0.15 | kJ/mol | 14.02658 ± 0.00081 | 2465-56-7*2 |
Ketene | CH2CO (g) | -45.46 | -48.57 | ± 0.15 | kJ/mol | 42.0367 ± 0.0016 | 463-51-4*0 |
Methylene fluoride | CH2F2 (g) | -443.46 | -451.04 | ± 0.46 | kJ/mol | 52.02339 ± 0.00081 | 75-10-5*0 |
Chloride | Cl- (g) | -228.953 | -227.346 | ± 0.003 | kJ/mol | 35.45325 ± 0.00090 | 16887-00-6*0 |
Methylene radical | CH2 (g, triplet) | 390.95 | 391.46 | ± 0.14 | kJ/mol | 14.02658 ± 0.00081 | 2465-56-7*1 |
Cyanogen fluoride | FCN (g) | 8.13 | 8.46 | ± 0.74 | kJ/mol | 45.01584 ± 0.00080 | 1495-50-7*0 |
Methoxy radical | CH3O (g) | 29.22 | 21.85 | ± 0.36 | kJ/mol | 31.03392 ± 0.00088 | 2143-68-2*0 |
Formyl | HCO (g) | 41.45 | 41.83 | ± 0.11 | kJ/mol | 29.01804 ± 0.00086 | 2597-44-6*0 |
Propyne | CH3CCH (g) | 192.89 | 185.83 | ± 0.37 | kJ/mol | 40.0639 ± 0.0024 | 74-99-7*0 |
Hypochlorite | [ClO]- (g) | -118.61 | -118.34 | ± 0.13 | kJ/mol | 51.45265 ± 0.00095 | 14380-61-1*0 |
Cyano radical | CN (g) | 436.68 | 439.97 | ± 0.15 | kJ/mol | 26.01744 ± 0.00080 | 2074-87-5*0 |
Cyanogen bromide | BrCN (g) | 187.55 | 180.75 | ± 0.78 | kJ/mol | 105.9214 ± 0.0013 | 506-68-3*0 |
1-Hydroxyethyl | CH3CHOH (g, gauche-anti) | -41.86 | -55.29 | ± 0.62 | kJ/mol | 45.0605 ± 0.0017 | 2348-46-1*1 |
2-Hydroxyethyl | CH2CH2OH (g, gauche-syn) | -12.55 | -25.82 | ± 0.61 | kJ/mol | 45.0605 ± 0.0017 | 4422-54-2*1 |
Oxygen atom anion | O- (g) | 105.868 | 108.097 | ± 0.002 | kJ/mol | 15.99995 ± 0.00030 | 14337-01-0*0 |
Ethyl chloride | CH3CH2Cl (g) | -96.65 | -111.24 | ± 0.22 | kJ/mol | 64.5138 ± 0.0019 | 75-00-3*0 |
Oxygen difluoride | FOF (g) | 26.93 | 24.67 | ± 0.25 | kJ/mol | 53.99621 ± 0.00030 | 7783-41-7*0 |
Nitrite | [ONO]- (g) | -182.67 | -185.48 | ± 0.46 | kJ/mol | 46.00609 ± 0.00060 | 14797-65-0*0 |
Nitrosyl hydride | HNO (g) | 109.89 | 106.92 | ± 0.11 | kJ/mol | 31.01408 ± 0.00032 | 14332-28-6*0 |
Vinyl | C2H3 (g) | 301.35 | 297.27 | ± 0.47 | kJ/mol | 27.0452 ± 0.0016 | 2669-89-8*0 |
Ethoxide | [CH3CH2O]- (g) | -163.23 | -178.17 | ± 0.51 | kJ/mol | 45.0610 ± 0.0017 | 16331-64-9*0 |
Phenylium | [C6H5]+ (g) | 1148.74 | 1136.84 | ± 0.95 | kJ/mol | 77.1034 ± 0.0048 | 17333-73-2*0 |
Methylenimine | H2CNH (g) | 96.61 | 88.70 | ± 0.98 | kJ/mol | 29.04126 ± 0.00083 | 2053-29-4*0 |
Hydride | H- (g) | 143.264 | 145.228 | ± 0.000 | kJ/mol | 1.008489 ± 0.000070 | 12184-88-2*0 |
Hypoiodous acid | HOI (g) | -56.5 | -61.3 | ± 2.0 | kJ/mol | 143.91181 ± 0.00031 | 14332-21-9*0 |
Amidogen | NH2 (g) | 188.94 | 186.05 | ± 0.15 | kJ/mol | 16.02262 ± 0.00016 | 13770-40-6*0 |
Hydroxylamine | NH2OH (g, trans) | -33.12 | -43.50 | ± 0.49 | kJ/mol | 33.02996 ± 0.00037 | 7803-49-8*1 |
Oxirane | O(CH2CH2) (g) | -40.14 | -52.68 | ± 0.44 | kJ/mol | 44.0526 ± 0.0017 | 75-21-8*0 |
Tetraiodomethane | CI4 (g) | 341.2 | 336.1 | ± 1.4 | kJ/mol | 519.62858 ± 0.00081 | 507-25-5*0 |
Chlorotrifluoromethane | CF3Cl (g) | -705.20 | -710.30 | ± 0.75 | kJ/mol | 104.4586 ± 0.0012 | 75-72-9*0 |
Bromotrifluoromethane | CF3Br (g) | -640.05 | -652.17 | ± 0.60 | kJ/mol | 148.9099 ± 0.0013 | 75-63-8*0 |
Chloroxyl radical | ClO (g) | 101.116 | 101.707 | ± 0.035 | kJ/mol | 51.45210 ± 0.00095 | 14989-30-1*0 |
Fluoromethylidyne | CF (g) | 243.16 | 246.76 | ± 0.15 | kJ/mol | 31.00910 ± 0.00080 | 3889-75-6*0 |
Tetrafluoroethylene | C2F4 (g) | -671.85 | -675.28 | ± 0.73 | kJ/mol | 100.0150 ± 0.0016 | 116-14-3*0 |
Fluoroxyl radical | FO (g) | 110.29 | 110.91 | ± 0.15 | kJ/mol | 34.99780 ± 0.00030 | 12061-70-0*0 |
Methylamine | CH3NH2 (g) | -5.83 | -20.91 | ± 0.53 | kJ/mol | 31.05714 ± 0.00088 | 74-89-5*0 |
Ethynyl | C2H (g) | 563.79 | 567.91 | ± 0.17 | kJ/mol | 25.0293 ± 0.0016 | 2122-48-7*0 |
Propane | CH3CH2CH3 (g) | -82.11 | -104.39 | ± 0.29 | kJ/mol | 44.0956 ± 0.0025 | 74-98-6*0 |
Ethoxy | CH3CH2O (g, X 2A") | 1.95 | -11.95 | ± 0.50 | kJ/mol | 45.0605 ± 0.0017 | 2154-50-9*51 |
Isocyanic acid | HNCO (g) | -116.06 | -119.05 | ± 0.37 | kJ/mol | 43.02478 ± 0.00086 | 75-13-8*0 |
Cyanato | NCO (g) | 126.89 | 127.36 | ± 0.39 | kJ/mol | 42.01684 ± 0.00086 | 22400-26-6*0 |
Chloroform | CCl3H (g) | -98.61 | -103.51 | ± 0.66 | kJ/mol | 119.3767 ± 0.0028 | 67-66-3*0 |
Methylene chloride | CH2Cl2 (g) | -87.82 | -94.68 | ± 0.60 | kJ/mol | 84.9320 ± 0.0020 | 75-09-2*0 |
Vinyl chloride | CH2CHCl (g) | 29.57 | 22.10 | ± 0.35 | kJ/mol | 62.4979 ± 0.0018 | 75-01-4*0 |
Acetone | CH3C(O)CH3 (g) | -199.38 | -216.07 | ± 0.37 | kJ/mol | 58.0791 ± 0.0025 | 67-64-1*0 |
Hydrogen fluoride | HF (aq) | | -334.53 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*800 |
Hypobromite | [BrO]- (g) | -96.22 | -103.70 | ± 0.55 | kJ/mol | 95.9039 ± 0.0010 | 14380-62-2*0 |
Trihydrogen cation | [H3]+ (g) | 1110.304 | 1106.696 | ± 0.013 | kJ/mol | 3.02327 ± 0.00021 | 28132-48-1*0 |
Diazenylium | [N2H]+ (g) | 1042.76 | 1039.14 | ± 0.74 | kJ/mol | 29.02087 ± 0.00016 | 12357-66-3*0 |
Methyl hydroperoxide | CH3OOH (g) | -114.98 | -127.81 | ± 0.91 | kJ/mol | 48.0413 ± 0.0010 | 3031-73-0*0 |
Hydroxyformyl | HOCO (g, trans) | -181.39 | -184.36 | ± 0.55 | kJ/mol | 45.0174 ± 0.0010 | 2564-86-5*1 |
Ethyl bromide | CH3CH2Br (g) | -41.19 | -63.13 | ± 0.28 | kJ/mol | 108.9651 ± 0.0019 | 74-96-4*0 |
Vinyl fluoride | CH2CHF (g) | -134.7 | -142.5 | ± 1.1 | kJ/mol | 46.0436 ± 0.0016 | 75-02-5*0 |
Vinyl bromide | CH2CHBr (g) | 88.48 | 73.68 | ± 0.62 | kJ/mol | 106.9492 ± 0.0019 | 593-60-2*0 |
2-Bromoethanol | BrCH2CH2OH (g) | -196.69 | -220.75 | ± 0.54 | kJ/mol | 124.9645 ± 0.0019 | 540-51-2*0 |
Fluorobenzene | C6H5F (g) | -99.72 | -115.40 | ± 1.02 | kJ/mol | 96.1023 ± 0.0048 | 462-06-6*0 |
Nitrous oxide | NNO (g) | 86.003 | 82.574 | ± 0.097 | kJ/mol | 44.01288 ± 0.00033 | 10024-97-2*0 |
(E)-Diazene | HNNH (g, trans) | 207.36 | 200.22 | ± 0.56 | kJ/mol | 30.02936 ± 0.00020 | 15626-43-4*0 |
Hydroxyoxomethylium | [HOCO]+ (g) | 600.83 | 597.97 | ± 0.49 | kJ/mol | 45.0169 ± 0.0010 | 638-71-1*0 |
Vinylium | [C2H3]+ (g) | 1118.86 | 1115.84 | ± 0.61 | kJ/mol | 27.0447 ± 0.0016 | 14604-48-9*0 |
Hydroxymethylium | [CH2OH]+ (g) | 718.00 | 710.06 | ± 0.24 | kJ/mol | 31.03337 ± 0.00088 | 18682-95-6*0 |
Cyanogen | NCCN (g) | 308.16 | 310.10 | ± 0.43 | kJ/mol | 52.0349 ± 0.0016 | 460-19-5*0 |
Cyanogen iodide | ICN (g) | 222.61 | 222.10 | ± 1.00 | kJ/mol | 152.92191 ± 0.00080 | 506-78-5*0 |
Peroxide ion | [HO2]- (g) | -88.83 | -91.54 | ± 0.39 | kJ/mol | 33.00729 ± 0.00060 | 14691-59-9*0 |
2-Chloroethanol | ClCH2CH2OH (g) | -250.05 | -266.76 | ± 0.61 | kJ/mol | 80.5132 ± 0.0019 | 107-07-3*0 |
Hydrogen chloride | HCl (aq, 600 H2O) | | -166.454 | ± 0.024 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*834 |
Methonium | [CH5]+ (g) | 921.69 | 911.03 | ± 0.49 | kJ/mol | 17.04985 ± 0.00087 | 15135-49-6*0 |
Hydroxyamidogen | HNOH (g, trans) | 101.54 | 94.70 | ± 1.00 | kJ/mol | 32.02202 ± 0.00034 | 13940-32-4*1 |
Nitrate | [NO3]- (g) | -300.11 | -306.58 | ± 0.61 | kJ/mol | 62.00549 ± 0.00090 | 14797-55-8*0 |
Hypofluorite | [FO]- (g) | -108.95 | -108.78 | ± 0.48 | kJ/mol | 34.99835 ± 0.00030 | 12763-66-5*0 |
Dioxygenyl fluoride | FOO (g) | 26.83 | 25.12 | ± 0.26 | kJ/mol | 50.99720 ± 0.00060 | 15499-23-7*0 |
Propylene | CH3CHCH2 (g) | 35.37 | 20.37 | ± 0.33 | kJ/mol | 42.0797 ± 0.0024 | 115-07-1*0 |
Acetyl | CH3CO (g) | -3.02 | -9.68 | ± 0.40 | kJ/mol | 43.0446 ± 0.0016 | 3170-69-2*0 |
Bromoform | CBr3H (g) | 73.5 | 47.4 | ± 1.3 | kJ/mol | 252.7306 ± 0.0031 | 75-25-2*0 |
2-Fluoroethanol | FCH2CH2OH (g) | -407.1 | -424.3 | ± 1.1 | kJ/mol | 64.0589 ± 0.0017 | 371-62-0*0 |
Phenide | [C6H5]- (g) | 244.90 | 231.99 | ± 0.44 | kJ/mol | 77.1044 ± 0.0048 | 30922-78-2*0 |
Bromobenzene | C6H5Br (g) | 127.0 | 104.9 | ± 1.3 | kJ/mol | 157.0079 ± 0.0049 | 108-86-1*0 |
Bromoxyl radical | BrO (g) | 131.15 | 123.61 | ± 0.30 | kJ/mol | 95.9034 ± 0.0010 | 15656-19-6*0 |
Iodine monochloride | ICl (g) | 19.024 | 17.391 | ± 0.013 | kJ/mol | 162.35717 ± 0.00090 | 7790-99-0*0 |
Iodotrifluoromethane | CF3I (g) | -584.62 | -590.50 | ± 0.63 | kJ/mol | 195.91038 ± 0.00080 | 2314-97-8 |
Nitroxyl | H2NO (g) | 71.34 | 64.73 | ± 0.85 | kJ/mol | 32.02202 ± 0.00034 | 13408-29-2*0 |
Hydrogen bromide | HBr (aq) | | -120.99 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*800 |
Peroxynitrous acid | HOONO (g, cis,cis) | -6.13 | -14.57 | ± 0.38 | kJ/mol | 63.01288 ± 0.00091 | 14691-52-2*3 |
Ethylium | [CH3CH2]+ (g) | 915.14 | 902.90 | ± 0.39 | kJ/mol | 29.0606 ± 0.0016 | 14936-94-8*0 |
Hydroxymethylene | HCOH (g, trans) | 111.96 | 108.19 | ± 0.43 | kJ/mol | 30.02598 ± 0.00087 | 19710-56-6*1 |
Formyl anion | [HCO]- (g) | 11.61 | 12.04 | ± 0.44 | kJ/mol | 29.01859 ± 0.00086 | 57340-31-5*0 |
2-Propynyl | CH2CCH (g) | 354.07 | 351.51 | ± 0.48 | kJ/mol | 39.0559 ± 0.0024 | 2932-78-7*0 |
1-Hydroxyethylium | [CH3CHOH]+ (g, anti) | 609.24 | 594.82 | ± 0.40 | kJ/mol | 45.0600 ± 0.0017 | 18682-96-7*1 |
Ethoxy | CH3CH2O (g, A 2A') | 6.20 | -8.23 | ± 0.50 | kJ/mol | 45.0605 ± 0.0017 | 2154-50-9*52 |
Methylperoxy | CH3OO (g) | 21.81 | 12.06 | ± 0.90 | kJ/mol | 47.0333 ± 0.0010 | 2143-58-0*0 |
Formic acid | HC(O)OH (g, anti) | -354.86 | -362.10 | ± 0.41 | kJ/mol | 46.0254 ± 0.0010 | 64-18-6*2 |
Formyloxy | HC(O)O (g, 2A1 only) | -123.60 | -125.28 | ± 0.61 | kJ/mol | 45.0174 ± 0.0010 | 16499-21-1*1 |
Formate | [HC(O)O]- (g) | -462.21 | -465.85 | ± 0.77 | kJ/mol | 45.0180 ± 0.0010 | 71-47-6*0 |
Phosgene | COCl2 (g) | -217.34 | -219.03 | ± 0.28 | kJ/mol | 98.9155 ± 0.0020 | 75-44-5*0 |
Chlorodifluoromethane | CHClF2 (g) | -476.7 | -482.8 | ± 1.2 | kJ/mol | 86.4681 ± 0.0012 | 75-45-6*0 |
Fluoromethylene | CHF (g, singlet) | 148.33 | 148.61 | ± 0.46 | kJ/mol | 32.01704 ± 0.00080 | 13453-52-6*2 |
Ethyl fluoride | CH3CH2F (g) | -257.67 | -272.54 | ± 0.96 | kJ/mol | 48.0595 ± 0.0016 | 353-36-6*0 |
Chlorobenzene | C6H5Cl (g) | 67.18 | 52.22 | ± 0.61 | kJ/mol | 112.5566 ± 0.0049 | 108-90-7*0 |
Ethynide | [C2H]- (g) | 277.40 | 280.90 | ± 0.41 | kJ/mol | 25.0299 ± 0.0016 | 29075-95-4*0 |
Amide | [NH2]- (g) | 114.98 | 112.11 | ± 0.34 | kJ/mol | 16.02317 ± 0.00016 | 17655-31-1*0 |
Hydrazine | H2NNH2 (g) | 109.66 | 95.51 | ± 0.19 | kJ/mol | 32.04524 ± 0.00031 | 302-01-2*0 |
Ethylidyne | CH3C (g) | 512.7 | 508.6 | ± 1.4 | kJ/mol | 27.0452 ± 0.0016 | 67624-57-1*0 |
Dihydrogen trioxide | HOOOH (g, trans) | -82.13 | -90.87 | ± 0.91 | kJ/mol | 50.01408 ± 0.00091 | 14699-99-1*1 |
Hydrogen trioxide anion | [HOOO]- (g, cis) | -121.7 | -125.3 | ± 1.7 | kJ/mol | 49.00669 ± 0.00090 | 89965-38-8*2 |
1-Hydroxyethyl | CH3CHOH (g, gauche-syn) | -40.33 | -53.80 | ± 0.87 | kJ/mol | 45.0605 ± 0.0017 | 2348-46-1*2 |
Protonated oxirane | [(CH2CH2)OH]+ (g) | 725.17 | 709.00 | ± 0.64 | kJ/mol | 45.0600 ± 0.0017 | *38607-31-7*0 |
Oxoethenyl | HCCO (g) | 176.85 | 177.97 | ± 0.60 | kJ/mol | 41.0287 ± 0.0016 | 51095-15-9*0 |
Methanediol | CH2(OH)2 (g, conrot gauche) | -379.20 | -393.40 | ± 0.96 | kJ/mol | 48.0413 ± 0.0010 | 463-57-0*1 |
Acetyl chloride | CH3C(O)Cl (g) | -232.59 | -241.46 | ± 0.34 | kJ/mol | 78.4973 ± 0.0019 | 75-36-5*0 |
Methylene bromide | CH2Br2 (g) | 24.5 | 3.1 | ± 1.2 | kJ/mol | 173.8346 ± 0.0022 | 74-95-3*0 |
Difluorodichloromethane | CF2Cl2 (g) | -491.05 | -495.81 | ± 0.98 | kJ/mol | 120.9129 ± 0.0020 | 75-71-8*0 |
Fluorodichloromethane | CHFCl2 (g) | -279.1 | -284.5 | ± 1.3 | kJ/mol | 102.9224 ± 0.0020 | 75-43-4*0 |
Hydrogen chloride | HCl (aq) | | -166.993 | ± 0.023 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*800 |
Iodoxyl radical | IO (g) | 127.0 | 125.0 | ± 1.1 | kJ/mol | 142.90387 ± 0.00030 | 14696-98-1*0 |
Nitrogen sesquioxide | ONNO2 (g) | 90.65 | 86.08 | ± 0.15 | kJ/mol | 76.01168 ± 0.00091 | 10544-73-7*0 |
Ammonium | [NH4]+ (g) | 643.02 | 631.71 | ± 0.21 | kJ/mol | 18.03795 ± 0.00029 | 14798-03-9*0 |
Ammonium | [NH4]+ (aq) | | -133.081 | ± 0.056 | kJ/mol | 18.03795 ± 0.00029 | 14798-03-9*800 |
Hydrazyl | N2H3 (g) | 235.51 | 224.86 | ± 0.93 | kJ/mol | 31.03730 ± 0.00025 | 13598-46-4*0 |
Hydrazoic acid | HNNN (g) | 298.13 | 291.83 | ± 0.58 | kJ/mol | 43.02816 ± 0.00022 | 7782-79-8*0 |
Dioxygen cation | [O2]+ (g) | 1164.585 | 1165.221 | ± 0.010 | kJ/mol | 31.99825 ± 0.00060 | 12185-07-8*0 |
1,2-Propadiene-1,3-diylidene | CCC (g) | 814.7 | 823.6 | ± 1.1 | kJ/mol | 36.0321 ± 0.0024 | 12075-35-3*0 |
Ethylidene | CH3CH (g, triplet) | 361.5 | 354.5 | ± 1.2 | kJ/mol | 28.0532 ± 0.0016 | 4218-50-2*1 |
Acetylium | [CH3CO]+ (g) | 666.77 | 659.60 | ± 0.74 | kJ/mol | 43.0441 ± 0.0016 | 15762-07-9*0 |
Hydrogen isocyanide cation | [HNC]+ (g) | 1352.9 | 1352.9 | ± 1.4 | kJ/mol | 27.02483 ± 0.00081 | 74158-11-5*0 |
Dihydrogen trioxide | HOOOH (g, cis) | -72.51 | -81.60 | ± 1.00 | kJ/mol | 50.01408 ± 0.00091 | 14699-99-1*2 |
2-Hydroxyethyl | CH2CH2OH (g, gauche-anti) | -9.73 | -22.36 | ± 0.86 | kJ/mol | 45.0605 ± 0.0017 | 4422-54-2*2 |
Methanediol | CH2(OH)2 (g, disrot gauche) | -368.67 | -381.82 | ± 1.00 | kJ/mol | 48.0413 ± 0.0010 | 463-57-0*2 |
Chloronium | [HClH]+ (g) | 881.5 | 878.4 | ± 1.2 | kJ/mol | 37.46803 ± 0.00091 | 36658-55-6*0 |
Trifluoromethylium | [CF3]+ (g) | 408.80 | 405.73 | ± 0.66 | kJ/mol | 69.00536 ± 0.00080 | 18851-76-8*0 |
Fluoroformyl | FCO (g) | -176.89 | -176.31 | ± 0.51 | kJ/mol | 47.00850 ± 0.00085 | 1871-24-5*0 |
Fluoronium | [HFH]+ (g) | 775.1 | 772.2 | ± 1.2 | kJ/mol | 21.01373 ± 0.00014 | 12206-67-6*0 |
Dioxygen difluoride | FOOF (g) | 37.33 | 33.61 | ± 0.38 | kJ/mol | 69.99561 ± 0.00060 | 7783-44-0*0 |
Bromonium | [HBrH]+ (g) | 925.2 | 914.5 | ± 1.7 | kJ/mol | 81.9193 ± 0.0010 | 36658-54-5*0 |
Oxonitrate anion | [NO]- (g) | 87.88 | 87.91 | ± 0.12 | kJ/mol | 30.00669 ± 0.00031 | 14967-78-3*0 |
Nitric acid | HNO3 (aq) | | -206.60 | ± 0.19 | kJ/mol | 63.01288 ± 0.00091 | 7697-37-2*800 |
Oxoammoniumyl | [HNO]+ (g) | 1092.48 | 1089.56 | ± 0.70 | kJ/mol | 31.01353 ± 0.00032 | 63559-87-5*0 |
Nitrous acid | HONO (g, trans) | -73.044 | -79.188 | ± 0.079 | kJ/mol | 47.01348 ± 0.00061 | 7782-77-6*1 |
Peroxynitrous acid | HOONO (g, trans,perp) | 7.57 | 0.49 | ± 0.42 | kJ/mol | 63.01288 ± 0.00091 | 14691-52-2*1 |
Ethynylene | C2 (g) | 820.31 | 828.37 | ± 0.30 | kJ/mol | 24.0214 ± 0.0016 | 12070-15-4*0 |
Ozonide ion | [OOO]- (g) | -58.50 | -60.85 | ± 0.21 | kJ/mol | 47.99875 ± 0.00090 | 12596-80-4*0 |
Hydrogen peroxide cation | [H2O2]+ (g, trans) | 896.75 | 889.79 | ± 0.60 | kJ/mol | 34.01413 ± 0.00062 | 12325-10-9*1 |
Ethylidene | CH3CH (g, singlet) | 374.6 | 366.9 | ± 1.2 | kJ/mol | 28.0532 ± 0.0016 | 4218-50-2*2 |
Iminomethyl cation | [HCNH]+ (g) | 953.4 | 949.4 | ± 1.6 | kJ/mol | 28.03277 ± 0.00082 | 196216-36-1*0 |
Dichloride | [Cl2]- (g) | -230.7 | -229.7 | ± 1.8 | kJ/mol | 70.9059 ± 0.0018 | 12595-89-0*0 |
2-Hydroxyethyl | CH2CH2OH (g, staggered-anti) | -4.7 | -17.2 | ± 1.2 | kJ/mol | 45.0605 ± 0.0017 | 4422-54-2*3 |
Ketene | CH2CO (g, triplet) | 182.6 | 179.5 | ± 1.3 | kJ/mol | 42.0367 ± 0.0016 | 463-51-4*1 |
Dicarbon monoxide | CCO (g, triplet) | 374.8 | 378.9 | ± 1.3 | kJ/mol | 40.0208 ± 0.0016 | 12071-23-7*1 |
Dimethyl ether | CH3OCH3 (g) | -166.51 | -184.02 | ± 0.44 | kJ/mol | 46.0684 ± 0.0017 | 115-10-6*0 |
Formic acid | HC(O)OH (g, syn-anti equilib) | -371.19 | -378.49 | ± 0.25 | kJ/mol | 46.0254 ± 0.0010 | 64-18-6*0 |
Hydroxyformyl | HOCO (g, cis) | -173.95 | -177.06 | ± 0.62 | kJ/mol | 45.0174 ± 0.0010 | 2564-86-5*2 |
Hydrogen fluoride | HF (aq, 20 H2O) | | -321.07 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*818 |
Fluorotrichloromethane | CCl3F (g) | -287.5 | -290.7 | ± 1.2 | kJ/mol | 137.3672 ± 0.0028 | 75-69-4*0 |
Bromotrichloromethane | CCl3Br (g) | -33.88 | -43.03 | ± 0.74 | kJ/mol | 198.2728 ± 0.0030 | 75-62-7*0 |
Chlorine fluoride | ClF (g) | -55.608 | -55.703 | ± 0.062 | kJ/mol | 54.45110 ± 0.00090 | 7790-89-8*0 |
Difluoromethylene | CF2 (g) | -193.87 | -193.40 | ± 0.43 | kJ/mol | 50.00751 ± 0.00080 | 2154-59-8*0 |
Fluoromethylene | CHF (g, triplet) | 210.17 | 210.51 | ± 0.69 | kJ/mol | 32.01704 ± 0.00080 | 13453-52-6*1 |
Oxygen atom cation | O+ (g) | 1560.786 | 1562.644 | ± 0.002 | kJ/mol | 15.99885 ± 0.00030 | 14581-93-2*0 |
Tricarbon dioxide | OCCCO (g) | -97.7 | -95.6 | ± 1.4 | kJ/mol | 68.0309 ± 0.0025 | 504-64-3*0 |
Hydrogen trioxide | OO(H)O (g) | 300.2 | 294.3 | ± 1.4 | kJ/mol | 49.00614 ± 0.00090 | *12500-78-6*0 |
Iodobenzene | C6H5I (g) | 177.9 | 161.9 | ± 1.1 | kJ/mol | 204.0084 ± 0.0048 | 591-50-4*0 |
Iodine monobromide | IBr (g) | 49.716 | 40.769 | ± 0.066 | kJ/mol | 206.8085 ± 0.0010 | 7789-33-5*0 |
Difluoride | [F2]- (g) | -292.3 | -291.5 | ± 1.6 | kJ/mol | 37.9973550 ± 0.0000010 | 12184-85-9*0 |
Water anion | [(H)(OH)]- (g, vdW) | 30.7 | 29.0 | ± 2.8 | kJ/mol | 18.01583 ± 0.00033 | 12259-30-2*100 |
Isodiazene | H2NN (g) | 308.00 | 300.94 | ± 0.81 | kJ/mol | 30.02936 ± 0.00020 | 28647-38-3*0 |
Methyl carbanion | [CH3]- (g) | 147.5 | 144.4 | ± 1.2 | kJ/mol | 15.03507 ± 0.00083 | 15194-58-8*0 |
Methyliumyl | [CH2]+ (g) | 1393.09 | 1393.62 | ± 0.14 | kJ/mol | 14.02603 ± 0.00081 | 15091-72-2*0 |
Bromine monochloride | BrCl (g) | 21.878 | 14.434 | ± 0.059 | kJ/mol | 115.3567 ± 0.0013 | 13863-41-7*0 |
(E)-Iminomethyl | HCNH (g, trans) | 276.2 | 272.6 | ± 1.4 | kJ/mol | 28.03332 ± 0.00082 | 54980-10-8*0 |
Fluoroacetylene | HCCF (g) | 103.71 | 104.42 | ± 0.95 | kJ/mol | 44.0277 ± 0.0016 | 2713-09-9*0 |
Chloroacetylene | HCCCl (g) | 228.1 | 229.0 | ± 1.1 | kJ/mol | 60.4820 ± 0.0018 | 593-63-5*0 |
1,2-Propadienyl anion | [CH2CCH]- (g) | 265.40 | 262.19 | ± 0.76 | kJ/mol | 39.0565 ± 0.0024 | 64066-06-4*0 |
1-Propynyl anion | [CH3CC]- (g) | 261.25 | 257.78 | ± 0.73 | kJ/mol | 39.0565 ± 0.0024 | 36147-87-2*0 |
2-Hydroxyethylium | [CH2CH2OH]+ (g, staggered-anti) | 1019.7 | 1006.9 | ± 1.7 | kJ/mol | 45.0600 ± 0.0017 | 38607-31-7*3 |
Vinyl alcohol | CH2CHOH (g, syn) | -112.40 | -123.71 | ± 0.91 | kJ/mol | 44.0526 ± 0.0017 | 557-75-5*1 |
Dicarbon monoxide | CCO (g, singlet) | 453.5 | 457.9 | ± 1.3 | kJ/mol | 40.0208 ± 0.0016 | 12071-23-7*2 |
Hydroxyformyl anion | [HOCO]- (g, cis) | -320.4 | -323.1 | ± 1.2 | kJ/mol | 45.0180 ± 0.0010 | 78944-70-4*2 |
Acetic acid | CH3C(O)OH (g, syn) | -418.75 | -432.87 | ± 0.64 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*1 |
Ethylene glycol | (CH2OH)2 (g) | -369.79 | -389.42 | ± 0.49 | kJ/mol | 62.0678 ± 0.0018 | 107-21-1*0 |
Fluorochloromethane | CH2FCl (g) | -256.6 | -263.7 | ± 1.3 | kJ/mol | 68.4777 ± 0.0012 | 593-70-4*0 |
Formyl fluoride | HFCO (g) | -378.94 | -382.53 | ± 0.49 | kJ/mol | 48.01644 ± 0.00086 | 1493-02-3*0 |
1,3-Butadiyne | HCCCCH (g) | 458.64 | 460.37 | ± 0.87 | kJ/mol | 50.0587 ± 0.0032 | 460-12-8*0 |
Hydroperoxonium | [H2OOH]+ (g) | 738.7 | 728.4 | ± 1.3 | kJ/mol | 35.02207 ± 0.00064 | 70850-26-9*0 |
Fluorobenzene cation | [C6H5F]+ (g) | 788.26 | 773.56 | ± 1.02 | kJ/mol | 96.1018 ± 0.0048 | 34468-25-2*0 |
Nitrosyl nitrite | ONONO (g, sym) | 91.2 | 86.1 | ± 1.6 | kJ/mol | 76.01168 ± 0.00091 | 122413-35-8*1 |
Dinitrogen pentoxide | O2NONO2 (g) | 24.33 | 14.76 | ± 0.35 | kJ/mol | 108.0105 ± 0.0015 | 10102-03-1*0 |
Hydrogen trioxide cation | [OO(H)O]+ (g) | 1297.4 | 1290.8 | ± 1.7 | kJ/mol | 49.00559 ± 0.00090 | *74241-49-9*0 |
Hydrogen difluoride cation | [FFH]+ (g) | 1175.5 | 1172.6 | ± 2.0 | kJ/mol | 39.004198 ± 0.000070 | *126950-54-7*0 |
Iodide | I- (aq) | | -56.824 | ± 0.090 | kJ/mol | 126.905019 ± 0.000030 | 20461-54-5*800 |
Fluoride | F- (aq) | | -334.53 | ± 0.17 | kJ/mol | 18.99895178 ± 0.00000050 | 16984-48-8*800 |
Carbon atom cation | C+ (g) | 1797.841 | 1803.439 | ± 0.057 | kJ/mol | 12.01015 ± 0.00080 | 14067-05-1*0 |
n-Butane | CH3(CH2)2CH3 (g) | -98.54 | -125.85 | ± 0.38 | kJ/mol | 58.1222 ± 0.0033 | 106-97-8 |
Vinyl anion | [C2H3]- (g) | 237.61 | 233.21 | ± 0.86 | kJ/mol | 27.0458 ± 0.0016 | 25012-81-1*0 |
Acetylene cation | [HCCH]+ (g) | 1328.65 | 1327.72 | ± 0.20 | kJ/mol | 26.0367 ± 0.0016 | 25641-79-6*0 |
Vinylidene | CCH2 (g) | 411.36 | 412.27 | ± 0.63 | kJ/mol | 26.0373 ± 0.0016 | 2143-69-3*0 |
Vinylidene anion | [CCH2]- (g) | 364.33 | 364.14 | ± 0.82 | kJ/mol | 26.0378 ± 0.0016 | 66295-36-1*0 |
Hydroperoxo cation | [HO2]+ (g) | 1110.90 | 1107.99 | ± 0.11 | kJ/mol | 33.00619 ± 0.00060 | 12207-52-2*0 |
Methylamidogen anion | [CH3NH]- (g) | 146.15 | 134.80 | ± 0.79 | kJ/mol | 30.04975 ± 0.00085 | 54448-39-4*0 |
Methyleneamidogen | H2CN (g) | 242.23 | 238.57 | ± 0.95 | kJ/mol | 28.03332 ± 0.00082 | 15845-29-1*0 |
(Z)-Iminomethyl | HCNH (g, cis) | 294.6 | 291.1 | ± 1.4 | kJ/mol | 28.03332 ± 0.00082 | 54980-11-9*0 |
Methyloxoniumylidene | [CH3O]+ (g) | 1062.60 | 1054.98 | ± 0.71 | kJ/mol | 31.03337 ± 0.00088 | 58157-09-8*0 |
Hydroxymethylene | HCOH (g, cis) | 130.40 | 126.66 | ± 0.43 | kJ/mol | 30.02598 ± 0.00087 | 19710-56-6*2 |
Hydroxymethylene cation | [HCOH]+ (g, trans) | 972.2 | 968.5 | ± 1.6 | kJ/mol | 30.02543 ± 0.00087 | 135395-06-1*1 |
Bromonium | Br+ (g) | 1257.775 | 1251.712 | ± 0.056 | kJ/mol | 79.9035 ± 0.0010 | 22541-56-6*0 |
Cyclopropene | CH2(CHCH) (g) | 292.66 | 283.93 | ± 0.58 | kJ/mol | 40.0639 ± 0.0024 | 2781-85-3*0 |
1-Propynyl | CH3CC (g) | 530.32 | 528.35 | ± 1.01 | kJ/mol | 39.0559 ± 0.0024 | 89342-91-6*0 |
1-Hydroxyethylium | [CH3CHOH]+ (g, syn) | 611.2 | 596.7 | ± 1.2 | kJ/mol | 45.0600 ± 0.0017 | 18682-96-7*2 |
Vinyl alcohol | CH2CHOH (g, anti) | -107.93 | -118.46 | ± 0.93 | kJ/mol | 44.0526 ± 0.0017 | 557-75-5*2 |
Vinyl alcohol cation | [CH2CHOH]+ (g, anti) | 779.3 | 768.1 | ± 1.3 | kJ/mol | 44.0520 ± 0.0017 | 57239-63-1*2 |
Oxoniumylidene ion | [OH]+ (g) | 1293.201 | 1293.231 | ± 0.036 | kJ/mol | 17.00679 ± 0.00031 | 12259-29-9*0 |
C=O=C | COC (g, triplet) | 652.6 | 656.9 | ± 2.3 | kJ/mol | 40.0208 ± 0.0016 | *12071-23-7*1 |
C=O=C | COC (g, singlet) | 720.8 | 725.2 | ± 1.7 | kJ/mol | 40.0208 ± 0.0016 | *12071-23-7*2 |
Oxirene | O(CHCH) (g, t-triplet) | 389.9 | 385.7 | ± 2.8 | kJ/mol | 42.0367 ± 0.0016 | 157-18-6*11 |
Ethynol | HCCOH (g) | 94.8 | 92.7 | ± 1.4 | kJ/mol | 42.0367 ± 0.0016 | 32038-79-2*0 |
Formic acid cation | [HC(O)OH]+ (g, syn) | 721.79 | 714.63 | ± 0.28 | kJ/mol | 46.0248 ± 0.0010 | 50614-05-6*1 |
Dioxirane | H2C(OO) (g) | 9.3 | 1.6 | ± 1.2 | kJ/mol | 46.0254 ± 0.0010 | 157-26-6*0 |
Hydroxyformyl anion | [HOCO]- (g, trans) | -314.5 | -316.5 | ± 1.2 | kJ/mol | 45.0180 ± 0.0010 | 78944-70-4*1 |
Formyloxy | HC(O)O (g, 2B2 only) | -116.40 | -119.73 | ± 0.77 | kJ/mol | 45.0174 ± 0.0010 | 16499-21-1*2 |
Isofulminic acid | HCNO (g) | 170.8 | 169.3 | ± 1.2 | kJ/mol | 43.02478 ± 0.00086 | 51060-05-0*0 |
Methanetetraylbisamidogen | NCN (g) | 445.3 | 445.7 | ± 1.8 | kJ/mol | 40.02418 ± 0.00081 | 2669-76-3*0 |
Methyl iodide | CH3I (l) | | -12.19 | ± 0.19 | kJ/mol | 141.93899 ± 0.00083 | 74-88-4*590 |
Bromide | Br- (aq) | | -120.99 | ± 0.15 | kJ/mol | 79.9045 ± 0.0010 | 24959-67-9*800 |
Difluoromethylene | CF2 (g, triplet) | 43.32 | 44.04 | ± 0.43 | kJ/mol | 50.00751 ± 0.00080 | 2154-59-8*1 |
Difluoromethylene | CF2 (g, singlet) | -193.87 | -193.40 | ± 0.43 | kJ/mol | 50.00751 ± 0.00080 | 2154-59-8*2 |
Ethyl iodide | CH3CH2I (l) | -9.30 | -39.16 | ± 0.38 | kJ/mol | 155.9656 ± 0.0016 | 75-03-6*500 |
Fluoro(fluorooxy)methylene | FCOF (g, cis) | -135.5 | -136.6 | ± 2.1 | kJ/mol | 66.00691 ± 0.00085 | 479587-30-9*2 |
Benzene | C6H6 (cr,l) | 50.79 | 49.24 | ± 0.26 | kJ/mol | 78.1118 ± 0.0048 | 71-43-2*500 |
Nitrosyl ion | [NO]+ (g) | 984.453 | 984.448 | ± 0.064 | kJ/mol | 30.00559 ± 0.00031 | 14452-93-8*0 |
(E)-Diazene cation | [HNNH]+ (g, trans) | 1132.59 | 1125.69 | ± 0.74 | kJ/mol | 30.02881 ± 0.00020 | 59952-06-6*0 |
(E)-Diazene anion | [HNNH]- (g, trans) | 269.3 | 262.4 | ± 1.7 | kJ/mol | 30.02991 ± 0.00020 | *59952-06-6*0 |
(Z)-Diazene | HNNH (g, cis) | 229.60 | 222.47 | ± 0.83 | kJ/mol | 30.02936 ± 0.00020 | 15626-42-3*0 |
Diazenyl | N2H (g) | 252.40 | 249.48 | ± 0.56 | kJ/mol | 29.02142 ± 0.00016 | 36882-13-0*0 |
Hydroxyaminiumyl | [NOH]+ (g) | 1160.2 | 1157.2 | ± 1.5 | kJ/mol | 31.01353 ± 0.00032 | 63559-88-6*0 |
Hydrogen trioxide cation | [HOOO]+ (g, trans) | 1067.7 | 1061.4 | ± 1.9 | kJ/mol | 49.00559 ± 0.00090 | 74241-49-9*1 |
Triiodide ion | [I3]- (aq) | | -51.44 | ± 0.83 | kJ/mol | 380.713959 ± 0.000090 | 14900-04-0*800 |
Hydroxyamidogen | HNOH (g, cis) | 123.5 | 117.0 | ± 1.4 | kJ/mol | 32.02202 ± 0.00034 | 13940-32-4*2 |
Hydroxyaminylium | [HNOH]+ (g, trans) | 1020.2 | 1013.0 | ± 2.0 | kJ/mol | 32.02147 ± 0.00034 | 66097-71-0*1 |
Peroxynitrous acid | HOONO (g, cis,perp) | -0.56 | -7.61 | ± 0.54 | kJ/mol | 63.01288 ± 0.00091 | 14691-52-2*2 |
Hydrogen trioxide anion | [OO(H)O]- (g) | 27.7 | 22.3 | ± 1.5 | kJ/mol | 49.00669 ± 0.00090 | *89965-38-8*0 |
Dioxiranylidene | C(OO) (g) | 189.0 | 189.8 | ± 1.8 | kJ/mol | 44.0095 ± 0.0010 | 138832-57-2*0 |
Deuterium atom | D (g) | 219.804 | 221.717 | ± 0.000 | kJ/mol | 2.01410177800 ± 0.00000000040 | 16873-17-9*0 |
Hypoiodite | [IO]- (g) | -102.5 | -104.4 | ± 1.2 | kJ/mol | 142.90442 ± 0.00030 | 15065-65-3*0 |
Oxoniumyl ion | [H2O]+ (g) | 978.484 | 975.611 | ± 0.029 | kJ/mol | 18.01473 ± 0.00033 | 56583-62-1*0 |
Aminomethylium | [CH2NH2]+ (g) | 764.0 | 752.1 | ± 1.8 | kJ/mol | 30.04865 ± 0.00085 | 488821-23-4*0 |
Aminomethylene | HCNH2 (g) | 246.6 | 238.9 | ± 1.7 | kJ/mol | 29.04126 ± 0.00083 | 35430-17-2*0 |
Methylimidogen | H3CN (g) | 323.8 | 316.0 | ± 1.6 | kJ/mol | 29.04126 ± 0.00083 | 27770-42-9*0 |
Methyleneamidogen anion | [H2CN]- (g) | 193.1 | 189.3 | ± 1.2 | kJ/mol | 28.03387 ± 0.00082 | 28892-56-0*0 |
Aminomethylidyne | CNH2 (g) | 372.3 | 368.8 | ± 1.5 | kJ/mol | 28.03332 ± 0.00082 | 84654-89-7*0 |
Fluorosyl ion | [FO]+ (g) | 1342.40 | 1342.35 | ± 0.83 | kJ/mol | 34.99725 ± 0.00030 | 12763-67-6*0 |
Cyano cation | [CN]+ (g) | 1779.2 | 1782.7 | ± 1.6 | kJ/mol | 26.01689 ± 0.00080 | 12539-57-0*0 |
Cyanide | [CN]- (g) | 63.971 | 67.257 | ± 0.099 | kJ/mol | 26.01799 ± 0.00080 | 57-12-5*0 |
Methanol cation | [CH3OH]+ (g) | 856.98 | 846.30 | ± 0.34 | kJ/mol | 32.04131 ± 0.00090 | 12538-91-9*0 |
Hydroxymethylene | HCOH (g, gauche triplet) | 219.1 | 216.0 | ± 1.4 | kJ/mol | 30.02598 ± 0.00087 | 19710-56-6*3 |
Hydroxymethylene anion | [HCOH]- (g, trans) | 148.2 | 145.3 | ± 1.8 | kJ/mol | 30.02653 ± 0.00087 | 207914-87-2*1 |
Isoformyl | COH (g) | 217.59 | 217.98 | ± 0.70 | kJ/mol | 29.01804 ± 0.00086 | 71080-92-7*0 |
Hydroxymethyliumylidene | [COH]+ (g) | 986.02 | 987.66 | ± 0.83 | kJ/mol | 29.01749 ± 0.00086 | 60528-75-8*0 |
Hydrotrioxy | HOOO (g, trans) | 62.59 | 59.09 | ± 0.38 | kJ/mol | 49.00614 ± 0.00090 | 12500-78-6*1 |
Vinyl alcohol cation | [CH2CHOH]+ (g, syn) | 787.5 | 776.4 | ± 1.1 | kJ/mol | 44.0520 ± 0.0017 | 57239-63-1*1 |
Acetyl anion | [CH3CO]- (g) | -43.8 | -49.4 | ± 2.0 | kJ/mol | 43.0452 ± 0.0016 | 78944-68-0*0 |
Ketene | CH2CO (g, singlet) | -45.46 | -48.57 | ± 0.15 | kJ/mol | 42.0367 ± 0.0016 | 463-51-4*2 |
COC vdW | (CO)(C) (g, triplet) | 589.0 | 597.7 | ± 1.8 | kJ/mol | 40.0208 ± 0.0016 | *12071-24-8*1 |
Oxirene | O(CHCH) (g, singlet) | 276.6 | 275.9 | ± 3.1 | kJ/mol | 42.0367 ± 0.0016 | 157-18-6*2 |
Oxirene | O(CHCH) (g, c-triplet) | 391.9 | 387.7 | ± 2.8 | kJ/mol | 42.0367 ± 0.0016 | 157-18-6*12 |
Methylperoxy anion | [CH3OO]- (g) | -90.27 | -100.41 | ± 0.99 | kJ/mol | 47.0339 ± 0.0010 | 35683-44-4*0 |
Dioxymethyl | H2COO (g) | 113.6 | 106.6 | ± 1.2 | kJ/mol | 46.0254 ± 0.0010 | 56077-92-0*0 |
Formyloxoniumylidene | [HC(O)O]+ (g) | 1015.2 | 1011.7 | ± 1.7 | kJ/mol | 45.0169 ± 0.0010 | 54375-27-8*0 |
Cyanic acid | HOCN (g) | -12.25 | -14.86 | ± 1.01 | kJ/mol | 43.02478 ± 0.00086 | 420-05-3*0 |
Fulminic acid | HONC (g) | 234.68 | 233.15 | ± 1.02 | kJ/mol | 43.02478 ± 0.00086 | 506-85-4*0 |
Cyanato cation | [NCO]+ (g) | 1261.55 | 1262.32 | ± 0.59 | kJ/mol | 42.01629 ± 0.00086 | 17247-99-3*0 |
Isocyanate | [NCO]- (g) | -221.26 | -221.38 | ± 0.57 | kJ/mol | 42.01739 ± 0.00086 | 71000-82-3*0 |
Nitrosomethylidyne | CNO (g) | 388.6 | 390.0 | ± 1.7 | kJ/mol | 42.01684 ± 0.00086 | 82267-15-0*0 |
Oxazirinyl | C(NO) (g) | 450.6 | 451.5 | ± 1.7 | kJ/mol | 42.01684 ± 0.00086 | 228850-18-8*0 |
Dimethylamine | (CH3)2NH (g) | 6.02 | -15.89 | ± 0.69 | kJ/mol | 45.0837 ± 0.0017 | 124-40-3*0 |
Trimethylamine | (CH3)3N (g) | 4.54 | -24.02 | ± 0.64 | kJ/mol | 59.1103 ± 0.0025 | 75-50-3*0 |
Isocyanogen | CNCN (g) | 410.7 | 413.0 | ± 1.6 | kJ/mol | 52.0349 ± 0.0016 | 83951-85-3*0 |
Diisocyanogen | CNNC (g) | 610.1 | 613.0 | ± 1.7 | kJ/mol | 52.0349 ± 0.0016 | 78800-21-2*0 |
Nitroxyl | NO3 (g) | 79.35 | 74.09 | ± 0.19 | kJ/mol | 62.00494 ± 0.00090 | 12033-49-7*0 |
Hydrogen fluoride | HF (aq, 40 H2O) | | -321.16 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*821 |
Difluorodibromomethane | CF2Br2 (g) | -366.8 | -384.5 | ± 1.4 | kJ/mol | 209.8155 ± 0.0022 | 75-61-6*0 |
Dichlorodibromomethane | CCl2Br2 (g) | 19.0 | 3.4 | ± 1.5 | kJ/mol | 242.7241 ± 0.0028 | 594-18-3*0 |
Bromodifluoromethane | CHF2Br (g) | -411.04 | -424.23 | ± 0.56 | kJ/mol | 130.9194 ± 0.0013 | 1511-62-2*0 |
1,2-Difluoroacetylene | FCCF (g) | 0.0 | 2.9 | ± 1.6 | kJ/mol | 62.0182 ± 0.0016 | 689-99-6*0 |
Fluoro(fluorooxy)methylene | FCOF (g, trans) | -38.7 | -40.2 | ± 2.0 | kJ/mol | 66.00691 ± 0.00085 | 479587-30-9*1 |
Hydroxyde ion | [OH]- (aq) | | -230.009 | ± 0.029 | kJ/mol | 17.00789 ± 0.00031 | 14280-30-9*800 |
Dihydrogen trioxide cation | [HOOOH]+ (g, trans) | 928.9 | 919.6 | ± 1.9 | kJ/mol | 50.01353 ± 0.00091 | 161321-37-5*2 |
Phenylium | [C6H5]+ (g, triplet) | 1251.8 | 1239.7 | ± 3.3 | kJ/mol | 77.1034 ± 0.0048 | 17333-73-2*1 |
Chlorobenzene cation | [C6H5Cl]+ (g) | 942.52 | 928.60 | ± 0.61 | kJ/mol | 112.5561 ± 0.0049 | 55450-32-3*0 |
Chlorobenzene | C6H5Cl (cr,l) | | 11.26 | ± 0.59 | kJ/mol | 112.5566 ± 0.0049 | 108-90-7*500 |
Bromobenzene cation | [C6H5Br]+ (g) | 995.1 | 973.8 | ± 1.3 | kJ/mol | 157.0074 ± 0.0049 | 55450-33-4*0 |
Iodobenzene | C6H5I (cr,l) | 113.0 | 113.1 | ± 1.1 | kJ/mol | 204.0084 ± 0.0048 | 591-50-4*500 |
1,2-Dichloroethane | (CClH2)2 (g) | -118.15 | -130.09 | ± 0.59 | kJ/mol | 98.9586 ± 0.0024 | 107-06-2*0 |
Hydroxyimidogen | NOH (g) | 217.39 | 214.51 | ± 0.95 | kJ/mol | 31.01408 ± 0.00032 | 35337-59-8*0 |
Nitrous acid | HONO (g, cis) | -71.25 | -77.61 | ± 0.39 | kJ/mol | 47.01348 ± 0.00061 | 7782-77-6*2 |
Hydroxyoxoammoniumyl | [HONO]+ (g, trans) | 983.7 | 977.2 | ± 1.7 | kJ/mol | 47.01293 ± 0.00061 | 80371-48-8*1 |
Hydrogen nitroxylate | [HONO]- (g, cis) | -107.7 | -112.3 | ± 2.0 | kJ/mol | 47.01403 ± 0.00061 | 24388-53-2*2 |
Hydroxydioxonitrate | [HNO3]- (g) | -191.2 | -195.5 | ± 2.9 | kJ/mol | 63.01343 ± 0.00091 | 58875-09-5*0 |
Nitrosyl chloride | ClNO (g) | 54.418 | 52.517 | ± 0.067 | kJ/mol | 65.45884 ± 0.00095 | 2696-92-6*0 |
Carbon atom anion | C- (g) | 589.612 | 594.758 | ± 0.057 | kJ/mol | 12.01125 ± 0.00080 | 14337-00-9*0 |
Ammonium nitrate | (NH4)NO3 (cr,l) | -350.26 | -365.22 | ± 0.19 | kJ/mol | 80.04344 ± 0.00095 | 6484-52-2*500 |
Dioxymethylidyne | COO (g) | 295.1 | 296.3 | ± 2.1 | kJ/mol | 44.0095 ± 0.0010 | 791121-04-5*0 |
Carbon monoxide cation | [CO]+ (g) | 1238.305 | 1241.585 | ± 0.026 | kJ/mol | 28.00955 ± 0.00085 | 12144-04-6*0 |
Propynylidyne cation | [C(CC)]+ (g) | 1953.8 | 1960.9 | ± 2.2 | kJ/mol | 36.0316 ± 0.0024 | 154702-35-9*0 |
Dioxygen anion | [O2]- (g) | -43.38 | -42.72 | ± 0.18 | kJ/mol | 31.99935 ± 0.00060 | 11062-77-4*0 |
Methylidyne radical | CH (g, quartet) | 664.53 | 667.87 | ± 0.68 | kJ/mol | 13.01864 ± 0.00080 | 3315-37-5*2 |
Peroxyimidogen | NOO (g) | 412.2 | 410.2 | ± 1.8 | kJ/mol | 46.00554 ± 0.00060 | *60488-31-5*0 |
Ethylene cation | [C2H4]+ (g) | 1075.39 | 1068.24 | ± 0.15 | kJ/mol | 28.0526 ± 0.0016 | 34470-02-5*0 |
Hydrogen trioxide cation | [HOOO]+ (g, cis) | 1083.1 | 1076.7 | ± 2.0 | kJ/mol | 49.00559 ± 0.00090 | 74241-49-9*2 |
Bifluoride | [FHF]- (g) | -710.3 | -714.2 | ± 2.4 | kJ/mol | 39.005295 ± 0.000070 | 18130-74-0*0 |
Dibromide | [Br2]- (g) | -200.1 | -214.2 | ± 2.0 | kJ/mol | 159.8085 ± 0.0020 | 12595-70-9*0 |
Hydrogen fluoride | HF (aq, 50 H2O) | | -321.19 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*822 |
Aminomethyl | CH2NH2 (g) | 159.63 | 148.74 | ± 1.01 | kJ/mol | 30.04920 ± 0.00085 | 10507-29-6*0 |
Methylamidogen | CH3NH (g) | 187.81 | 177.08 | ± 0.89 | kJ/mol | 30.04920 ± 0.00085 | 15622-51-2*0 |
Oxadiazirine | O(NN) (g) | 352.5 | 350.6 | ± 1.8 | kJ/mol | 44.01288 ± 0.00033 | 227934-45-4*0 |
Iminomethyl anion | [HCNH]- (g, trans) | 239.0 | 235.2 | ± 2.0 | kJ/mol | 28.03387 ± 0.00082 | 90623-30-6*1 |
Hydrogen isocyanide | HNC (g) | 191.58 | 191.96 | ± 0.57 | kJ/mol | 27.02538 ± 0.00081 | 6914-07-4*0 |
Methyleneoxonium | CH2OH2 (g) | 158.0 | 149.2 | ± 4.1 | kJ/mol | 32.04186 ± 0.00090 | 177788-17-9*0 |
NON | NON (g) | 543.8 | 540.6 | ± 1.8 | kJ/mol | 44.01288 ± 0.00033 | 227934-46-5*0 |
Aminylium | [NH2]+ (g) | 1266.50 | 1263.78 | ± 0.18 | kJ/mol | 16.02207 ± 0.00016 | 15194-15-7*0 |
1-Hydroxyethylium | [CH3CHOH]+ (g) | 609.24 | 594.82 | ± 0.40 | kJ/mol | 45.0600 ± 0.0017 | 18682-96-7*0 |
Chlorine atom cation | Cl+ (g) | 1370.806 | 1372.602 | ± 0.002 | kJ/mol | 35.45215 ± 0.00090 | 24203-47-2*0 |
Acetaldehyde cation | [CH3CHO]+ (g) | 832.10 | 822.12 | ± 0.32 | kJ/mol | 44.0520 ± 0.0017 | 36505-03-0*0 |
Dibromine monoxide | BrOBr (g) | 121.1 | 104.6 | ± 1.3 | kJ/mol | 175.8074 ± 0.0020 | 21308-80-5*0 |
Ethynol anion | [HCCO]- (g) | -48.62 | -47.37 | ± 0.87 | kJ/mol | 41.0293 ± 0.0016 | 64066-01-9*0 |
Dicarbon monoxide anion | [CCO]- (g) | 152.6 | 156.3 | ± 1.4 | kJ/mol | 40.0213 ± 0.0016 | 87191-88-6*0 |
Nitrosyl nitrite | ONONO (g, t,c) | 108.3 | 104.2 | ± 1.8 | kJ/mol | 76.01168 ± 0.00091 | 122413-35-8*2 |
Nitrogen atom cation | N+ (g) | 1872.901 | 1875.682 | ± 0.024 | kJ/mol | 14.006191 ± 0.000070 | 14158-23-7*0 |
Dicarbon monoxide cation | [CCO]+ (g) | 1431.5 | 1436.6 | ± 2.2 | kJ/mol | 40.0203 ± 0.0016 | 12287-08-0*0 |
COC vdW | (CO)(C) (g, singlet) | 726.4 | 734.7 | ± 1.7 | kJ/mol | 40.0208 ± 0.0016 | *12071-24-8*2 |
C=O-C cation | [COC]+ (g, doublet) | 1575.9 | 1582.9 | ± 2.3 | kJ/mol | 40.0203 ± 0.0016 | 83483-98-1*1 |
C=O=C anion | [COC]- (g) | 550.4 | 554.2 | ± 2.1 | kJ/mol | 40.0213 ± 0.0016 | *87191-88-6*0 |
Hydrogen fluoride | HF (aq, 22 H2O) | | -321.09 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*902 |
Formic acid cation | [HC(O)OH]+ (g, anti) | 723.7 | 716.7 | ± 1.4 | kJ/mol | 46.0248 ± 0.0010 | 50614-05-6*2 |
Formic acid anion | [HC(O)OH]- (g, syn) | -254.5 | -260.7 | ± 2.3 | kJ/mol | 46.0259 ± 0.0010 | 19066-82-1*1 |
OH-CO vdW complex | (OH)(CO) (g, vdW) | -80.30 | -77.40 | ± 0.96 | kJ/mol | 45.0174 ± 0.0010 | *2564-85-4*100 |
CO-HO vdW complex | (CO)(HO) (g, vdW) | -77.6 | -73.6 | ± 1.8 | kJ/mol | 45.0174 ± 0.0010 | *2564-84-3*100 |
H-CO2 vdW complex | (H)(CO2) (g, vdW) | -179.3 | -178.4 | ± 2.2 | kJ/mol | 45.0174 ± 0.0010 | *2564-83-2*100 |
Isocyanic acid cation | [HNCO]+ (g) | 1002.80 | 1000.39 | ± 0.56 | kJ/mol | 43.02423 ± 0.00086 | 444010-28-0*0 |
Isofulminic acid cation | [HCNO]+ (g) | 1215.4 | 1212.7 | ± 1.6 | kJ/mol | 43.02423 ± 0.00086 | 114766-65-3*0 |
Dioxaziridinyl | N(OO) (g) | 354.2 | 351.7 | ± 1.6 | kJ/mol | 46.00554 ± 0.00060 | 66252-29-7*0 |
Acetic acid | CH3C(O)OH (aq, 1500 H2O) | | -484.82 | ± 0.25 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*840 |
Acetyl chloride | CH3C(O)Cl (l) | | -272.12 | ± 0.34 | kJ/mol | 78.4973 ± 0.0019 | 75-36-5*500 |
Glyoxal | (CHO)2 (g, trans) | -206.85 | -212.48 | ± 0.59 | kJ/mol | 58.0361 ± 0.0017 | 107-22-2*1 |
Diazoethenylidene | NNCC (g) | 656.9 | 659.5 | ± 3.0 | kJ/mol | 52.0349 ± 0.0016 | 130760-10-0*0 |
Isocyanomethylidyne | CNC (g) | 670.3 | 674.7 | ± 4.0 | kJ/mol | 38.0281 ± 0.0016 | 53590-27-5*0 |
Tetrachloromethane | CCl4 (l) | -110.68 | -130.09 | ± 0.75 | kJ/mol | 153.8215 ± 0.0037 | 56-23-5*500 |
Trifluoromethide | [CF3]- (g) | -638.7 | -640.5 | ± 1.9 | kJ/mol | 69.00646 ± 0.00080 | 54128-17-5*0 |
Chloroform | CCl3H (l) | | -133.95 | ± 0.64 | kJ/mol | 119.3767 ± 0.0028 | 67-66-3*590 |
Fluorotribromomethane | CBr3F (g) | -108.3 | -132.3 | ± 1.6 | kJ/mol | 270.7211 ± 0.0031 | 353-54-8*0 |
Chlorotribromomethane | CBr3Cl (g) | 75.9 | 53.0 | ± 1.6 | kJ/mol | 287.1754 ± 0.0032 | 594-15-0*0 |
Fluorochlorate | [ClF]- (g) | -257.9 | -257.3 | ± 3.8 | kJ/mol | 54.45165 ± 0.00090 | 12272-56-9*0 |
Fluoromethyliumylidene | [CF]+ (g) | 1122.67 | 1125.89 | ± 0.56 | kJ/mol | 31.00855 ± 0.00080 | 33412-11-2*0 |
Fluoromethylene | CHF (g) | 148.33 | 148.61 | ± 0.46 | kJ/mol | 32.01704 ± 0.00080 | 13453-52-6*0 |
Chloride | Cl- (aq) | | -166.993 | ± 0.023 | kJ/mol | 35.45325 ± 0.00090 | 16887-00-6*800 |
Hydrogen fluoride | HF (aq, 35 H2O) | | -321.15 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*904 |
Ethyl iodide | CH3CH2I (g) | 8.82 | -7.06 | ± 0.38 | kJ/mol | 155.9656 ± 0.0016 | 75-03-6*0 |
1,2-Dichloroacetylene | ClCCCl (g) | 230.5 | 233.8 | ± 1.9 | kJ/mol | 94.9268 ± 0.0024 | 7572-29-4*0 |
1,2-Dibromoacetylene | BrCCBr (g) | 333.0 | 322.1 | ± 3.6 | kJ/mol | 183.8294 ± 0.0026 | 624-61-3*0 |
Fluoro(fluorooxy)methylene | FCOF (g, vdW triplet) | -100.8 | -99.0 | ± 2.1 | kJ/mol | 66.00691 ± 0.00085 | 479587-30-9*101 |
Fluorooxomethylium | [FCO]+ (g) | 724.2 | 723.9 | ± 1.5 | kJ/mol | 47.00795 ± 0.00085 | 38264-00-5*0 |
Fluoroisoformyl | COF (g) | -39.2 | -33.8 | ± 1.8 | kJ/mol | 47.00850 ± 0.00085 | *1871-24-5*0 |
Dibromophosgene | COBr2 (g) | -97.59 | -113.53 | ± 0.43 | kJ/mol | 187.8181 ± 0.0022 | 593-95-3*0 |
Benzene cation | [C6H6]+ (g) | 992.58 | 976.11 | ± 0.26 | kJ/mol | 78.1113 ± 0.0048 | 34504-50-2*0 |
o-Benzyne | C6H4 (g) | 469.7 | 460.8 | ± 1.4 | kJ/mol | 76.0960 ± 0.0048 | 462-80-6*0 |
o-Benzyne anion | [C6H4]- (g) | 415.6 | 407.0 | ± 1.5 | kJ/mol | 76.0965 ± 0.0048 | 100569-88-8*0 |
Ammonia | NH3 (aq, undissoc) | | -80.890 | ± 0.054 | kJ/mol | 17.03056 ± 0.00022 | 7664-41-7*1000 |
1,2-Dibromoethane | (CBrH2)2 (g) | -10.8 | -37.6 | ± 1.3 | kJ/mol | 187.8612 ± 0.0026 | 106-93-4*0 |
1,1-Difluoroethane | CHF2CH3 (g) | -486.7 | -500.5 | ± 5.8 | kJ/mol | 66.0500 ± 0.0016 | 75-37-6 |
1,1-Dichloroethane | CHCl2CH3 (g) | -114.7 | -127.4 | ± 1.1 | kJ/mol | 98.9586 ± 0.0024 | 75-34-3*0 |
Ethylene anion | [C2H4]- (g, anti) | 236.8 | 229.2 | ± 2.3 | kJ/mol | 28.0537 ± 0.0016 | 34527-91-8*1 |
Peroxyimidogen anion | [NOO]- (g) | 162.7 | 160.3 | ± 1.7 | kJ/mol | 46.00609 ± 0.00060 | 60488-31-5*0 |
Ethylidyne | CH3C (g, quartet) | 642.0 | 637.5 | ± 2.3 | kJ/mol | 27.0452 ± 0.0016 | 67624-57-1*2 |
Nitric acid | HNO3 (aq, 1000 H2O) | | -206.28 | ± 0.19 | kJ/mol | 63.01288 ± 0.00091 | 7697-37-2*839 |
Acetylene anion | [HCCH]- (g, trans) | 359.5 | 359.3 | ± 3.0 | kJ/mol | 26.0378 ± 0.0016 | 50443-89-5*1 |
Nirous oxide cation | [NNO]+ (g) | 1329.68 | 1326.78 | ± 0.12 | kJ/mol | 44.01233 ± 0.00033 | 12269-46-4*0 |
Ethynylium | [C2H]+ (g) | 1687.64 | 1690.97 | ± 0.18 | kJ/mol | 25.0288 ± 0.0016 | 16456-59-0*0 |
Methylammonium | [CH3NH3]+ (g) | 628.8 | 609.7 | ± 2.5 | kJ/mol | 32.06453 ± 0.00091 | 17000-00-9*0 |
Hydrogen chloride | HCl (aq, 2000 H2O) | | -166.684 | ± 0.024 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*841 |
Nitric acid | HNO3 (cr,l) | -178.98 | -173.25 | ± 0.19 | kJ/mol | 63.01288 ± 0.00091 | 7697-37-2*500 |
Oxadiazirine anion | [O(NN)]- (g) | 99.7 | 100.0 | ± 2.6 | kJ/mol | 44.01343 ± 0.00033 | 350586-31-1*0 |
Iminomethyl anion | [HCNH]- (g, cis) | 254.3 | 250.5 | ± 2.0 | kJ/mol | 28.03387 ± 0.00082 | 90623-30-6*2 |
Hydrogen cyanide cation | [HCN]+ (g) | 1442.54 | 1442.07 | ± 0.21 | kJ/mol | 27.02483 ± 0.00081 | 12601-62-6*0 |
Dihydrogen trioxide cation | [HOOOH]+ (g, c,t) | 939.3 | 930.1 | ± 2.0 | kJ/mol | 50.01353 ± 0.00091 | 161321-37-5*3 |
Dioxygenyl ion monohydrate | [(H2O)(O2)]+ (g) | 831.3 | 824.5 | ± 3.0 | kJ/mol | 50.01353 ± 0.00091 | 11083-61-7*0 |
Water dimer | (H2O)2 (g) | -492.20 | -499.61 | ± 0.11 | kJ/mol | 36.03056 ± 0.00066 | 25655-83-8*0 |
Methyleneoxonium cation | [CH2OH2]+ (g) | 829.9 | 819.7 | ± 4.5 | kJ/mol | 32.04131 ± 0.00090 | *177788-17-9*0 |
Hydroxymethylide | [CH2OH]- (g) | 9.8 | 3.2 | ± 1.8 | kJ/mol | 31.03447 ± 0.00088 | 55830-71-2*0 |
Formaldehyde cation | [H2CO]+ (g) | 945.25 | 941.72 | ± 0.13 | kJ/mol | 30.02543 ± 0.00087 | 54288-05-0*0 |
Hydroxymethylene cation | [HCOH]+ (g, cis) | 986.9 | 983.4 | ± 1.8 | kJ/mol | 30.02543 ± 0.00087 | 135395-06-1*2 |
Hydroxymethylene cation | [HCOH]+ (g, gauche quartet) | 1481.9 | 1479.1 | ± 2.1 | kJ/mol | 30.02543 ± 0.00087 | 135395-06-1*3 |
Hydroxymethylene anion | [HCOH]- (g, cis) | 161.6 | 159.7 | ± 1.9 | kJ/mol | 30.02653 ± 0.00087 | 207914-87-2*2 |
Hydroxymethylene anion | [HCOH]- (g, gauche quartet) | 333.7 | 333.0 | ± 2.5 | kJ/mol | 30.02653 ± 0.00087 | 207914-87-2*3 |
Aquacarbon | H2OC (g, triplet) | 441.4 | 439.5 | ± 2.1 | kJ/mol | 30.02598 ± 0.00087 | 81434-73-3*1 |
Aquacarbon | H2OC (g, singlet vdW) | 470.2 | 467.5 | ± 2.4 | kJ/mol | 30.02598 ± 0.00087 | 81434-73-3*102 |
Isoformyl anion | [COH]- (g) | 50.8 | 53.4 | ± 2.7 | kJ/mol | 29.01859 ± 0.00086 | 81747-63-9*0 |
Cyclopropane | CH2(CH2CH2) (g) | 70.78 | 53.64 | ± 0.52 | kJ/mol | 42.0797 ± 0.0024 | 75-19-4*0 |
Trioxodinitrate anion | [ONNO2]- (g, vdW) | -103.0 | -106.9 | ± 2.9 | kJ/mol | 76.01223 ± 0.00091 | 194856-62-7*100 |
1-Cyclopropen-1-yl | CH2(CHC) (g) | 528.55 | 523.96 | ± 0.87 | kJ/mol | 39.0559 ± 0.0024 | 19528-44-0*0 |
Cyclopropenyl | CH(CHCH) (g) | 491.42 | 486.81 | ± 0.88 | kJ/mol | 39.0559 ± 0.0024 | 28933-84-8*0 |
(Z)-Diazene cation | [HNNH]+ (g, cis) | 1157.3 | 1150.5 | ± 1.4 | kJ/mol | 30.02881 ± 0.00020 | 86631-37-0*0 |
2-Hydroxyethylium | [CH2CH2OH]+ (g, gauche) | 1024.8 | 1012.2 | ± 2.3 | kJ/mol | 45.0600 ± 0.0017 | 38607-31-7*1 |
Hydrogen chloride | HCl (aq, 75 H2O) | | -165.558 | ± 0.027 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*825 |
Ethoxy | CH3CH2O (g) | 1.95 | -11.47 | ± 0.50 | kJ/mol | 45.0605 ± 0.0017 | 2154-50-9*0 |
Hydrogen fluoride | HF (l) | | -302.43 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*590 |
Ethyloxoniumylidene | [CH3CH2O]+ (g) | 989.1 | 975.4 | ± 1.8 | kJ/mol | 45.0600 ± 0.0017 | 54387-07-4*0 |
(Z)-Diazene anion | [HNNH]- (g, cis) | 284.1 | 277.6 | ± 1.7 | kJ/mol | 30.02991 ± 0.00020 | *86631-37-0*0 |
Dioxygenyl fluoride cation | [FOO]+ (g) | 1215.1 | 1212.7 | ± 3.1 | kJ/mol | 50.99665 ± 0.00060 | 139584-95-5*0 |
1-Hydrazinylium-1-yl | [H2NN]+ (g) | 1145.2 | 1138.2 | ± 1.5 | kJ/mol | 30.02881 ± 0.00020 | 63986-30-1*0 |
Nitrosyl nitrite anion | [ONONO]- (g, sym) | -100.9 | -104.0 | ± 4.4 | kJ/mol | 76.01223 ± 0.00091 | *122413-35-8*1 |
Dioxaziridinyl anion | [N(OO)]- (g) | 295.1 | 292.6 | ± 1.7 | kJ/mol | 46.00609 ± 0.00060 | 66252-31-1*0 |
C=O-C cation | [COC]+ (g, quartet) | 1812.2 | 1816.2 | ± 2.3 | kJ/mol | 40.0203 ± 0.0016 | 83483-98-1*2 |
Isodiazene anion | [H2NN]- (g) | 387.1 | 380.3 | ± 1.8 | kJ/mol | 30.02991 ± 0.00020 | *63986-30-1*0 |
Oxirene cation | [O(CHCH)]+ (g) | 1109.7 | 1106.1 | ± 5.3 | kJ/mol | 42.0361 ± 0.0016 | 94664-69-4*0 |
2,4,5-Trioxa-1,3-diazabicyclo[1.1.1]pentane | N(O3)N (g) | 602.6 | 593.3 | ± 2.0 | kJ/mol | 76.01168 ± 0.00091 | 224950-18-9*0 |
Formic acid anion | [HC(O)OH]- (g, anti) | -239.4 | -245.1 | ± 2.4 | kJ/mol | 46.0259 ± 0.0010 | 19066-82-1*2 |
Dinitrogen tetraoxide | O2NNO2 (g) | 20.06 | 10.77 | ± 0.13 | kJ/mol | 92.0111 ± 0.0012 | 10544-72-6*0 |
Dioxirane cation | [H2C(OO)]+ (g) | 1051.3 | 1043.7 | ± 2.2 | kJ/mol | 46.0248 ± 0.0010 | 232262-10-1*0 |
Dioxymethyl cation | [H2COO]+ (g) | 1076.0 | 1069.2 | ± 1.9 | kJ/mol | 46.0248 ± 0.0010 | 232262-11-2*0 |
Dioxymethylene | HCOO (g, cis) | 332.1 | 329.9 | ± 5.9 | kJ/mol | 45.0174 ± 0.0010 | 438586-67-5*2 |
Hydroxyoxoammoniumyl | [HONO]+ (g, cis) | 1014.8 | 1008.5 | ± 1.8 | kJ/mol | 47.01293 ± 0.00061 | 80371-48-8*2 |
Hydrogen fluoride | HF (aq, 10 H2O) | | -320.91 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*815 |
Hydrogen fluoride | HF (aq, 18 H2O) | | -321.06 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*901 |
Hydrogen nitroxylate | [HONO]- (g, trans) | -106.8 | -110.7 | ± 2.0 | kJ/mol | 47.01403 ± 0.00061 | 24388-53-2*1 |
Aminyliumyl | [NH]+ (g) | 1658.98 | 1659.91 | ± 0.25 | kJ/mol | 15.014131 ± 0.000099 | 19067-62-0*0 |
Water | H2O (l) | | -285.825 | ± 0.027 | kJ/mol | 18.01528 ± 0.00033 | 7732-18-5*590 |
Nitrosomethyliumylidene | [CNO]+ (g) | 1509.5 | 1511.7 | ± 2.1 | kJ/mol | 42.01629 ± 0.00086 | 67197-19-7*0 |
Fulminate | [CNO]- (g) | 59.4 | 59.6 | ± 2.0 | kJ/mol | 42.01739 ± 0.00086 | 28269-67-2*0 |
Azido radical | N3 (g) | 452.51 | 449.92 | ± 0.73 | kJ/mol | 42.02022 ± 0.00021 | 12596-60-0*0 |
Acetic acid | CH3C(O)OH (l) | -484.00 | -483.58 | ± 0.20 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*500 |
Acetic acid | CH3C(O)OH (aq) | | -485.09 | ± 0.25 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*800 |
Acetic acid | CH3C(O)OH (aq, 75 H2O) | | -484.61 | ± 0.25 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*825 |
Acetic acid | CH3C(O)OH (aq, 700 H2O) | | -484.80 | ± 0.25 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*835 |
Carbon dioxide | CO2 (g, triplet) | 48.9 | 49.6 | ± 2.4 | kJ/mol | 44.0095 ± 0.0010 | 124-38-9*1 |
Glyoxal | (CHO)2 (g, cis) | -188.42 | -193.86 | ± 0.73 | kJ/mol | 58.0361 ± 0.0017 | 107-22-2*2 |
Glyoxal | (CHO)2 (g) | -206.85 | -212.41 | ± 0.59 | kJ/mol | 58.0361 ± 0.0017 | 107-22-2*0 |
Hydroxylamine | NH2OH (g, cis) | -14.7 | -25.2 | ± 1.5 | kJ/mol | 33.02996 ± 0.00037 | 7803-49-8*2 |
Hydroxylamine cation | [NH2OH]+ (g) | 858.0 | 848.1 | ± 1.8 | kJ/mol | 33.02941 ± 0.00037 | 62675-55-2*0 |
Isocyanogen anion | [CNCN]- (g, trans) | 383.9 | 387.6 | ± 2.5 | kJ/mol | 52.0354 ± 0.0016 | *83951-85-3*1 |
Diisocyanogen cation | [CNNC]+ (g, trans) | 1823.0 | 1825.8 | ± 3.5 | kJ/mol | 52.0343 ± 0.0016 | *78800-21-2*1 |
Cyanomethylidyne | CCN (g) | 673.9 | 678.3 | ± 4.4 | kJ/mol | 38.0281 ± 0.0016 | 4120-02-9*0 |
Hydrogen bromide | HBr (aq, 5000 H2O) | | -120.81 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*844 |
Diazomethylene | CNN (g) | 572.8 | 573.5 | ± 3.2 | kJ/mol | 40.02418 ± 0.00081 | 2468-81-7*0 |
Hydrogen fluoride | HF (aq, 30 H2O) | | -321.13 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*820 |
Diiodide | [I2]- (g) | -178.13 | -180.72 | ± 0.48 | kJ/mol | 253.809489 ± 0.000060 | 12190-71-5*0 |
Trifluoride ion | [F3]- (g) | -363.3 | -364.3 | ± 3.2 | kJ/mol | 56.9957582 ± 0.0000015 | 25730-99-8*0 |
Azide ion | [N3]- (g) | 194.2 | 190.6 | ± 1.1 | kJ/mol | 42.02077 ± 0.00021 | 14343-69-2*0 |
Dihydrogen cation | [H2]+ (g) | 1488.364 | 1488.480 | ± 0.000 | kJ/mol | 2.01533 ± 0.00014 | 12184-90-6*0 |
Fluorochlorobromomethane | CHFClBr (g) | -219.3 | -231.8 | ± 5.5 | kJ/mol | 147.3737 ± 0.0016 | 593-98-6*0 |
Iodine atom cation | I+ (g) | 1115.549 | 1115.149 | ± 0.006 | kJ/mol | 126.903921 ± 0.000030 | 22541-93-1*0 |
Fluoromethyliumyl | [CHF]+ (g) | 1116.9 | 1117.2 | ± 2.1 | kJ/mol | 32.01649 ± 0.00080 | 89877-52-1*0 |
Fluoromethylene anion | [CHF]- (g) | 95.94 | 96.47 | ± 0.63 | kJ/mol | 32.01759 ± 0.00080 | 71267-42-0*0 |
Polytetrafluoroethylene | C2F4 (s) | | -829.48 | ± 0.60 | kJ/mol | 100.0150 ± 0.0016 | 9002-84-0*591 |
2-Cyclopropyn-1-ylidene | C(CC) (g, triplet) | 905.0 | 911.9 | ± 2.0 | kJ/mol | 36.0321 ± 0.0024 | 102508-15-6*1 |
Aminium | [NH3]+ (g) | 944.272 | 937.317 | ± 0.030 | kJ/mol | 17.03001 ± 0.00022 | 19496-55-0*0 |
Hydrogen fluoride | HF (aq, 60 H2O) | | -321.21 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*823 |
Nitrous acid | HONO (g) | -73.044 | -78.701 | ± 0.079 | kJ/mol | 47.01348 ± 0.00061 | 7782-77-6*0 |
Bromoacetylene | HCCBr (g) | 282.4 | 275.9 | ± 2.2 | kJ/mol | 104.9333 ± 0.0019 | 593-61-3*0 |
Nitroxyl cation | [H2NO]+ (g) | 946.32 | 939.19 | ± 0.84 | kJ/mol | 32.02147 ± 0.00034 | *51375-41-8*0 |
Methane cation | [CH4]+ (g) | 1150.93 | 1143.81 | ± 0.27 | kJ/mol | 16.04191 ± 0.00085 | 20741-88-2*0 |
Formyl fluoride cation | [HFCO]+ (g) | 816.3 | 813.0 | ± 1.3 | kJ/mol | 48.01589 ± 0.00086 | 99766-68-4*0 |
Formyl fluoride | [FCO]- (g) | -405.4 | -403.9 | ± 1.7 | kJ/mol | 47.00905 ± 0.00085 | 62227-71-8*0 |
Fluoroisoformyl cation | [COF]+ (g) | 1347.4 | 1348.9 | ± 2.2 | kJ/mol | 47.00795 ± 0.00085 | *1871-25-6*0 |
Trihydrogen dioxide anion | [HOHOH]- (g) | -487.4 | -494.9 | ± 1.2 | kJ/mol | 35.02317 ± 0.00064 | 12501-19-8*0 |
Hydrogen difluoride | FHF (g) | -203.6 | -203.8 | ± 2.5 | kJ/mol | 39.004746 ± 0.000070 | 12528-21-1*0 |
Hydrogen bromide | HBr (aq, 600 H2O) | | -120.51 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*834 |
Hydrogen chloride | HCl (aq, 100 H2O) | | -165.759 | ± 0.025 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*828 |
Dioxygen difluoride cation | [FOOF]+ (g, trans) | 1292.9 | 1289.0 | ± 4.7 | kJ/mol | 69.99506 ± 0.00060 | *7783-44-0*1 |
Hydroxyaminylium | [HNOH]+ (g, cis) | 1049.2 | 1042.1 | ± 2.0 | kJ/mol | 32.02147 ± 0.00034 | 66097-71-0*2 |
Hydroxyamidogen anion | [HNOH]- (g) | 91.2 | 85.4 | ± 2.1 | kJ/mol | 32.02257 ± 0.00034 | *66097-71-0*0 |
Ethylidene anion | [CH3CH]- (g) | 328.4 | 320.9 | ± 2.1 | kJ/mol | 28.0537 ± 0.0016 | 35829-99-3*0 |
Formaldehyde anion | [H2CO]- (g) | -24.0 | -27.7 | ± 2.2 | kJ/mol | 30.02653 ± 0.00087 | 27837-46-3*0 |
Hypofluorous acid anion | [HOF]- (g) | 152.7 | 152.0 | ± 3.8 | kJ/mol | 36.00629 ± 0.00031 | 36505-07-4*0 |
Hydrogen trioxide cation | [HOOO]+ (g) | 1067.7 | 1061.4 | ± 1.9 | kJ/mol | 49.00559 ± 0.00090 | 74241-49-9*0 |
Bifluoride | [FFH]- (g) | -477.2 | -477.6 | ± 3.2 | kJ/mol | 39.005295 ± 0.000070 | *18130-74-0*0 |
Hydrogen chloride | HCl (aq, 150 H2O) | | -165.981 | ± 0.025 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*829 |
Bromine dioxide | OBrO (g) | 167.8 | 158.2 | ± 2.8 | kJ/mol | 111.9028 ± 0.0012 | 21255-83-4*0 |
Ethyloxoniumyl | [CH3CH2OH]+ (g) | 795.42 | 778.30 | ± 0.76 | kJ/mol | 46.0679 ± 0.0017 | 34480-55-2*0 |
Ethanol | CH3CH2OH (l) | -269.27 | -277.03 | ± 0.22 | kJ/mol | 46.0684 ± 0.0017 | 64-17-5*500 |
Hypochlorous acid anion | [HOCl]- (g) | 194.2 | 193.9 | ± 3.0 | kJ/mol | 52.46059 ± 0.00095 | 34524-94-2*0 |
Trioxodinitrate anion | [ONNO2]- (g, non-vdW only) | -85.5 | -92.6 | ± 2.7 | kJ/mol | 76.01223 ± 0.00091 | 194856-62-7*1 |
1-Hydroxyethyl anion | [CH3CHOH]- (g) | -19.7 | -33.1 | ± 2.5 | kJ/mol | 45.0610 ± 0.0017 | 88032-18-2*0 |
Dioxygen difluoride cation | [FOOF]+ (g, cis) | 1295.7 | 1291.7 | ± 4.7 | kJ/mol | 69.99506 ± 0.00060 | *7783-44-0*2 |
Dinitrogen cation | [N2]+ (g) | 1503.311 | 1503.312 | ± 0.001 | kJ/mol | 28.01293 ± 0.00014 | 13966-04-6*0 |
Acetylene anion | [HCCH]- (g, cis) | 383.0 | 383.3 | ± 3.2 | kJ/mol | 26.0378 ± 0.0016 | 50443-89-5*2 |
Hypofluorous acid cation | [HOF]+ (g) | 1142.02 | 1139.09 | ± 0.90 | kJ/mol | 36.00519 ± 0.00031 | 90243-22-4*0 |
Acetaldehyde anion | [CH3CHO]- (g) | -59.3 | -69.8 | ± 2.5 | kJ/mol | 44.0531 ± 0.0017 | 60427-04-5*0 |
Nirous oxide anion | [NNO]- (g) | 100.3 | 97.7 | ± 2.2 | kJ/mol | 44.01343 ± 0.00033 | 12274-12-3*0 |
Ketene cation | [CH2CO]+ (g) | 882.11 | 879.10 | ± 0.15 | kJ/mol | 42.0361 ± 0.0016 | 64999-16-2*0 |
Ketene anion | [CH2CO]- (g) | -14.7 | -17.7 | ± 2.4 | kJ/mol | 42.0372 ± 0.0016 | 56391-79-8*0 |
Hydrogen chloride | HCl (aq, 140 H2O) | | -165.947 | ± 0.026 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*907 |
Oxoethenylium | [HCCO]+ (g) | 1139.0 | 1141.7 | ± 2.5 | kJ/mol | 41.0282 ± 0.0016 | 92056-63-8*0 |
Hydrooxonitrate | [HNO]- (g) | 80.0 | 77.1 | ± 1.2 | kJ/mol | 31.01463 ± 0.00032 | 66057-02-1*0 |
Ammonium bromide | (NH4)Br (cr) | -253.76 | -270.33 | ± 0.17 | kJ/mol | 97.9425 ± 0.0010 | 12124-97-9*510 |
Methylammoniumyl | [CH3NH2]+ (g) | 866.9 | 853.2 | ± 2.4 | kJ/mol | 31.05659 ± 0.00088 | 34516-31-9*0 |
Nitrosyl nitrite anion | [ONONO]- (g, t,c) | -97.4 | -100.6 | ± 4.4 | kJ/mol | 76.01223 ± 0.00091 | *122413-35-8*2 |
Methylamine anion | [CH3NH2]- (g) | 69.1 | 54.9 | ± 4.0 | kJ/mol | 31.05769 ± 0.00088 | 81096-79-9*0 |
Nitrate | [NO3]- (aq) | | -206.60 | ± 0.19 | kJ/mol | 62.00549 ± 0.00090 | 14797-55-8*800 |
Ethynol cation | [HCCOH]+ (g) | 1063.0 | 1060.8 | ± 2.6 | kJ/mol | 42.0361 ± 0.0016 | 84005-02-7*0 |
Methyl hydroperoxide cation | [CH3OOH]+ (g) | 834.7 | 822.1 | ± 5.7 | kJ/mol | 48.0407 ± 0.0010 | 112465-88-0*0 |
Hydrogen chloride | HCl (aq, 1500 H2O) | | -166.638 | ± 0.025 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*840 |
Methoxyoxoniumylidene | [CH3OO]+ (g) | 1010.9 | 1002.5 | ± 2.4 | kJ/mol | 47.0328 ± 0.0010 | 86475-50-5*0 |
Carbon atom | C (g, singlet) | 833.319 | 838.466 | ± 0.057 | kJ/mol | 12.01070 ± 0.00080 | 7440-44-0*2 |
Aminomethyl anion | [CH2NH2]- (g) | 212.1 | 201.1 | ± 2.8 | kJ/mol | 30.04975 ± 0.00085 | 74215-21-7*0 |
Hypobromous acid cation | [HOBr]+ (g) | 975.23 | 964.65 | ± 0.60 | kJ/mol | 96.9108 ± 0.0010 | 154804-02-1*0 |
Nitric acid cation | [HNO3]+ (g) | 1029.30 | 1020.24 | ± 0.70 | kJ/mol | 63.01233 ± 0.00091 | 272109-63-4*0 |
Methylaminilium | [CH3NH]+ (g) | 1135.2 | 1125.2 | ± 2.5 | kJ/mol | 30.04865 ± 0.00085 | 49784-84-1*0 |
Dioxirane anion | [H2C(OO)]- (g) | -170.5 | -177.9 | ± 3.9 | kJ/mol | 46.0259 ± 0.0010 | *157-26-6*0 |
Dioxymethyl anion | [H2COO]- (g) | 57.2 | 51.2 | ± 2.5 | kJ/mol | 46.0259 ± 0.0010 | 93207-29-5*0 |
Hydrogen fluoride | HF (aq, 23 H2O) | | -321.09 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*903 |
Hydrogen fluoride | HF (aq, 55.51 H2O) | | -321.20 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*891 |
Nitrosyl nitrate | ONONO2 (g, cis) | 59.5 | 51.8 | ± 2.2 | kJ/mol | 92.0111 ± 0.0012 | 15969-55-8*2 |
Chloroniumyl ion | [HCl]+ (g) | 1137.797 | 1137.731 | ± 0.006 | kJ/mol | 36.46009 ± 0.00090 | 12258-94-5*0 |
Formyloxy | HC(O)O (g) | -123.60 | -125.06 | ± 0.61 | kJ/mol | 45.0174 ± 0.0010 | 16499-21-1*0 |
Dioxiranyl | HC(OO) (g) | 216.2 | 212.8 | ± 2.1 | kJ/mol | 45.0174 ± 0.0010 | 120595-16-6*0 |
Methanimine cation | [H2CNH]+ (g) | 1055.9 | 1048.8 | ± 2.2 | kJ/mol | 29.04071 ± 0.00083 | 65130-65-6*0 |
Dioxymethylene | HCOO (g, trans) | 359.0 | 356.6 | ± 5.9 | kJ/mol | 45.0174 ± 0.0010 | 438586-67-5*1 |
Methanimine anion | [H2CNH]- (g) | 228.7 | 221.4 | ± 2.5 | kJ/mol | 29.04181 ± 0.00083 | 127593-73-1*0 |
Aminomethyliumyl | [HCNH2]+ (g) | 1040.8 | 1033.1 | ± 2.6 | kJ/mol | 29.04071 ± 0.00083 | 89302-94-3*0 |
Aminomethylene anion | [HCNH2]- (g) | 357.1 | 350.2 | ± 2.6 | kJ/mol | 29.04181 ± 0.00083 | 207914-86-1*0 |
Diazene ion | [N2H]- (g) | 176.5 | 175.1 | ± 2.2 | kJ/mol | 29.02197 ± 0.00016 | 71004-29-0*0 |
Methylaminyliumyl | [H3CN]+ (g, quartet) | 1478.4 | 1471.2 | ± 2.6 | kJ/mol | 29.04071 ± 0.00083 | 56924-51-7*2 |
Methylimidogen anion | [H3CN]- (g) | 322.3 | 314.6 | ± 1.8 | kJ/mol | 29.04181 ± 0.00083 | 82539-34-2*0 |
Oxazirinyl cation | [C(NO)]+ (g) | 1566.7 | 1567.4 | ± 2.8 | kJ/mol | 42.01629 ± 0.00086 | *228850-18-8 |
Oxazirinyl anion | [C(NO)]- (g) | 449.8 | 450.6 | ± 2.8 | kJ/mol | 42.01739 ± 0.00086 | 28269-68-3 |
Acetic acid | CH3C(O)OH (g, syn-anti equilib) | -418.75 | -432.87 | ± 0.64 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*0 |
Methyleneaminylium | [H2CN]+ (g, triplet) | 1457.2 | 1453.6 | ± 2.5 | kJ/mol | 28.03277 ± 0.00082 | 53518-13-1*1 |
Hydrogen fluoride | HF (aq, 37 H2O) | | -321.15 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*890 |
Hydrogen chloride | HCl (aq, 74 H2O) | | -165.548 | ± 0.027 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*953 |
Methyl formate | HC(O)OCH3 (g) | -344.54 | -357.80 | ± 0.59 | kJ/mol | 60.0520 ± 0.0017 | 107-31-3*0 |
Trinitrogen cation | [N3]+ (g) | 1519.4 | 1516.9 | ± 1.2 | kJ/mol | 42.01967 ± 0.00021 | 12185-03-4*0 |
Methylidyne anion | [CH]- (g) | 474.07 | 477.41 | ± 0.65 | kJ/mol | 13.01919 ± 0.00080 | 28604-54-8*0 |
Oxalic acid | (COOH)2 (g) | -710.8 | -721.4 | ± 2.1 | kJ/mol | 90.0349 ± 0.0020 | 144-62-7*0 |
Fluorine atom cation | F+ (g) | 1758.316 | 1760.614 | ± 0.057 | kJ/mol | 18.99785462 ± 0.00000050 | 14701-13-4*0 |
Aminomethyliumylidene | [CNH2]+ (g) | 1168.9 | 1165.7 | ± 2.6 | kJ/mol | 28.03277 ± 0.00082 | 86784-42-1*0 |
Isocyanogen anion | [CNCN]- (g, cis) | 386.6 | 389.5 | ± 2.9 | kJ/mol | 52.0354 ± 0.0016 | *83951-85-3*2 |
Ozone cation | [OOO]+ (g) | 1352.872 | 1351.065 | ± 0.042 | kJ/mol | 47.99765 ± 0.00090 | 12596-82-6*0 |
Diisocyanogen cation | [CNNC]+ (g, cis) | 1835.0 | 1837.7 | ± 3.5 | kJ/mol | 52.0343 ± 0.0016 | *78800-21-2*2 |
Hydroxyimidogen anion | [NOH]- (g) | 232.7 | 230.2 | ± 2.5 | kJ/mol | 31.01463 ± 0.00032 | *35337-59-8*0 |
Ethylene anion | [C2H4]- (g, syn) | 237.7 | 231.6 | ± 2.4 | kJ/mol | 28.0537 ± 0.0016 | 34527-91-8*2 |
Hydrogen cyanide anion | [HCN]- (g) | 239.6 | 240.0 | ± 2.7 | kJ/mol | 27.02593 ± 0.00081 | 12334-27-9*0 |
Hydrogen fluoride | HF (aq, 22.2 H2O) | | -321.09 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*888 |
Hydrogen bromide | HBr (aq, 2000 H2O) | | -120.70 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*841 |
Dihydrooxooxygen cation | [(H2O)O]+ (g) | 994.6 | 988.0 | ± 1.8 | kJ/mol | 34.01413 ± 0.00062 | 177329-59-8*0 |
Trifluorine cation | [F3]+ (g) | 1538.5 | 1536.5 | ± 3.4 | kJ/mol | 56.9946610 ± 0.0000015 | 64710-22-1*0 |
Hypochlorous acid cation | [HOCl]+ (g) | 993.8 | 990.7 | ± 3.2 | kJ/mol | 52.45949 ± 0.00095 | 71606-47-8*0 |
Dioxaziridinyl cation | [N(OO)]+ (g) | 1361.3 | 1358.7 | ± 2.0 | kJ/mol | 46.00499 ± 0.00060 | *66252-29-7*0 |
Dioxygenyl fluoride anion | [FOO]- (g) | -252.0 | -252.2 | ± 3.1 | kJ/mol | 50.99775 ± 0.00060 | 23553-17-5*0 |
Hydrogen chloride | HCl (aq, 2439 H2O) | | -166.714 | ± 0.024 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*951 |
Hydrogen peroxide cation | [H2O2]+ (g, cis) | 931.0 | 924.2 | ± 1.1 | kJ/mol | 34.01413 ± 0.00062 | 12325-10-9*2 |
Imidogen anion | [NH]- (g) | 322.62 | 322.67 | ± 0.17 | kJ/mol | 15.015229 ± 0.000099 | 23841-33-0*0 |
Fluorobromomethane | CH2FBr (g) | -198.0 | -212.4 | ± 5.5 | kJ/mol | 112.9290 ± 0.0013 | 373-52-4*0 |
Chlorobromomethane | CH2ClBr (g) | -30.7 | -44.7 | ± 5.5 | kJ/mol | 129.3833 ± 0.0016 | 74-97-5*0 |
Nitrogen hydride oxide | H3NO (g) | 72.3 | 61.1 | ± 1.7 | kJ/mol | 33.02996 ± 0.00037 | 38544-48-8*0 |
Fluorodibromomethane | CHFBr2 (g) | -160.0 | -179.5 | ± 5.5 | kJ/mol | 191.8250 ± 0.0022 | 1868-53-7*0 |
Bromodichloromethane | CHCl2Br (g) | -39.8 | -51.5 | ± 5.5 | kJ/mol | 163.8280 ± 0.0022 | 75-27-4*0 |
Chlorodibromomethane | CHClBr2 (g) | 15.8 | -3.0 | ± 5.5 | kJ/mol | 208.2793 ± 0.0023 | 124-48-1*0 |
Hydrazinylium | [N2H3]+ (g) | 969.6 | 958.4 | ± 1.2 | kJ/mol | 31.03675 ± 0.00025 | 37369-93-0*0 |
Difluorochlorobromomethane | CF2ClBr (g) | -431.4 | -442.2 | ± 5.5 | kJ/mol | 165.3642 ± 0.0016 | 353-59-3*0 |
Dichlorofluorobromomethane | CCl2FBr (g) | -230.2 | -240.0 | ± 5.5 | kJ/mol | 181.8185 ± 0.0022 | 353-58-2*0 |
Dibromofluorochloromethane | CBr2FCl (g) | -170.8 | -187.4 | ± 5.5 | kJ/mol | 226.2698 ± 0.0023 | 353-55-9*0 |
Dinitrogen pentoxide | O2NONO2 (cr,l) | | -41.14 | ± 0.43 | kJ/mol | 108.0105 ± 0.0015 | 10102-03-1*500 |
Difluoromethyliumyl | [CF2]+ (g) | 908.56 | 908.99 | ± 0.95 | kJ/mol | 50.00696 ± 0.00080 | 54250-40-7*0 |
Fluoroniumyl ion | [HF]+ (g) | 1275.571 | 1275.803 | ± 0.058 | kJ/mol | 20.005795 ± 0.000070 | 12381-92-9*0 |
2-Cyclopropyn-1-ylidene | C(CC) (g, singlet) | 999.1 | 1005.9 | ± 2.7 | kJ/mol | 36.0321 ± 0.0024 | 102508-15-6*2 |
Oxywater | (H2O)O (g) | 64.8 | 58.4 | ± 1.5 | kJ/mol | 34.01468 ± 0.00062 | 171363-09-0*0 |
Hydrogen fluoride | HF (aq, 55 H2O) | | -321.20 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*905 |
Difluorophosgene cation | [COF2]+ (g) | 653.26 | 650.62 | ± 0.62 | kJ/mol | 66.00636 ± 0.00085 | 73256-56-1*0 |
Difluorophosgene anion | [COF2]- (g) | -603.5 | -605.4 | ± 2.9 | kJ/mol | 66.00745 ± 0.00085 | 474815-26-4*0 |
Dibromine | Br2 (aq) | | -2.16 | ± 0.21 | kJ/mol | 159.8080 ± 0.0020 | 7726-95-6*800 |
Bromosyl ion | [BrO]+ (g) | 1139.8 | 1132.1 | ± 1.3 | kJ/mol | 95.9029 ± 0.0010 | 142315-39-7*0 |
Nitryl ion | [ONO]+ (g) | 961.75 | 958.19 | ± 0.20 | kJ/mol | 46.00499 ± 0.00060 | 14522-82-8*0 |
Fluorosyl fluoride | FFO (g) | 189.2 | 189.5 | ± 4.8 | kJ/mol | 53.99621 ± 0.00030 | 86825-57-2*0 |
Dibromophosgene | COBr2 (l) | | -144.26 | ± 0.96 | kJ/mol | 187.8181 ± 0.0022 | 593-95-3*590 |
2-Chloroethanol | ClCH2CH2OH (l) | | -315.10 | ± 0.54 | kJ/mol | 80.5132 ± 0.0019 | 107-07-3*590 |
Hydrogen bromide | HBr (aq, 2570 H2O) | | -120.74 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*952 |
2-Bromoethanol | BrCH2CH2OH (l) | | -275.00 | ± 0.47 | kJ/mol | 124.9645 ± 0.0019 | 540-51-2*590 |
Nitroxyl anion | [H2NO]- (g) | 49.3 | 42.3 | ± 1.8 | kJ/mol | 32.02257 ± 0.00034 | 51375-41-8*0 |
Hydroxyoxoammoniumyl | [HONO]+ (g) | 983.7 | 977.2 | ± 1.7 | kJ/mol | 47.01293 ± 0.00061 | 80371-48-8*0 |
Hydrogen bromide | HBr (aq, 3000 H2O) | | -120.75 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*842 |
Phenylium | [C6H5]+ (g, singlet) | 1148.74 | 1136.84 | ± 0.95 | kJ/mol | 77.1034 ± 0.0048 | 17333-73-2*2 |
Methanol anion | [CH3OH]- (g) | 54.7 | 45.6 | ± 3.1 | kJ/mol | 32.04241 ± 0.00090 | 68474-04-4*0 |
Fluorobenzene | C6H5F (cr,l) | -152.44 | -150.02 | ± 1.02 | kJ/mol | 96.1023 ± 0.0048 | 462-06-6*500 |
Ammonium chloride | (NH4)Cl (cr) | -311.727 | -314.889 | ± 0.063 | kJ/mol | 53.49120 ± 0.00095 | 12125-02-9*510 |
1-Ethylium-1-yl | [CH3CH]+ (g) | 1185.7 | 1178.6 | ± 2.6 | kJ/mol | 28.0526 ± 0.0016 | 85944-79-2*0 |
Bromobenzene | C6H5Br (cr,l) | | 60.2 | ± 1.3 | kJ/mol | 157.0079 ± 0.0049 | 108-86-1*500 |
Isobutane | CH3CH(CH3)CH3 (g) | -106.76 | -135.36 | ± 0.40 | kJ/mol | 58.1222 ± 0.0033 | 75-28-5 |
Acetone | CH3C(O)CH3 (cr,l) | -244.33 | -247.45 | ± 0.37 | kJ/mol | 58.0791 ± 0.0025 | 67-64-1*500 |
2-Propanol | CH3CHOHCH3 (cr,l) | -305.35 | -318.15 | ± 0.36 | kJ/mol | 60.0950 ± 0.0025 | 67-63-0*500 |
Monoammonium succinate | (CH2COOH)2(NH3) (cr) | | -1067.95 | ± 0.72 | kJ/mol | 135.1186 ± 0.0035 | 38457-08-8*510 |
Diammonium succinate | (CH2COOH)2(NH3)2 (cr) | | -1182.49 | ± 0.48 | kJ/mol | 152.1492 ± 0.0035 | 2226-88-2*510 |
1,2-Dichloroethane | (CClH2)2 (cr,l) | | -165.24 | ± 0.59 | kJ/mol | 98.9586 ± 0.0024 | 107-06-2*500 |
Methyliumylidene | [CH]+ (g) | 1620.15 | 1623.49 | ± 0.28 | kJ/mol | 13.01809 ± 0.00080 | 24361-82-8*0 |
1,1-Dichloroethane | CHCl2CH3 (cr,l) | | -158.1 | ± 1.1 | kJ/mol | 98.9586 ± 0.0024 | 75-34-3*500 |
Nitric acid trihydrate | HNO3(H2O)3 (cr,l) | -1062.05 | -1055.20 | ± 0.22 | kJ/mol | 117.0587 ± 0.0019 | 13444-83-2*500 |
Oxygen difluoride anion | [FOF]- (g) | -194.0 | -194.4 | ± 3.8 | kJ/mol | 53.99675 ± 0.00030 | *7783-41-7*0 |
Ethane anion | [C2H6]- (g) | 8.4 | -7.0 | ± 3.2 | kJ/mol | 30.0696 ± 0.0017 | 54064-82-3*0 |
NON cation | [NON]+ (g) | 1444.1 | 1444.3 | ± 2.7 | kJ/mol | 44.01233 ± 0.00033 | *227934-46-5*0 |
Hydrotrioxy | HOOO (g) | 62.59 | 58.30 | ± 0.38 | kJ/mol | 49.00614 ± 0.00090 | 12500-78-6*0 |
Hydrogen chloride | HCl (aq, 1000 H2O) | | -166.567 | ± 0.024 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*839 |
Carbon dioxide anion | [CO2]- (g) | -340.2 | -339.7 | ± 2.4 | kJ/mol | 44.0100 ± 0.0010 | 14485-07-5*0 |
Bromoniumyl | [HBr]+ (g) | 1097.67 | 1089.82 | ± 0.15 | kJ/mol | 80.9114 ± 0.0010 | 12258-64-9*0 |
Dioxiranylidene cation | [C(OO)]+ (g) | 1409.3 | 1411.7 | ± 6.0 | kJ/mol | 44.0090 ± 0.0010 | *138832-57-2*0 |
Hydraziniumyl | [H2NNH2]+ (g) | 887.4 | 873.7 | ± 2.5 | kJ/mol | 32.04469 ± 0.00031 | 20771-51-1*0 |
Dioxiranylidene anion | [C(OO)]- (g, open) | -111.6 | -111.1 | ± 3.5 | kJ/mol | 44.0100 ± 0.0010 | *138832-58-3*0 |
Hydrazoic acid cation | [HNNN]+ (g) | 1333.94 | 1328.26 | ± 0.89 | kJ/mol | 43.02761 ± 0.00022 | 58852-14-5*0 |
Dioxygen | O2 (g, singlet) | 94.410 | 94.383 | ± 0.000 | kJ/mol | 31.99880 ± 0.00060 | 7782-44-7*2 |
NON anion | [NON]- (g) | 498.1 | 495.6 | ± 2.7 | kJ/mol | 44.01343 ± 0.00033 | *227934-47-6*0 |
Hydrazine anion | [H2NNH2]- (g) | 210.9 | 197.0 | ± 3.7 | kJ/mol | 32.04579 ± 0.00031 | 65391-88-0*0 |
Nitrato | [NO3]+ (g) | 1290.51 | 1285.80 | ± 0.86 | kJ/mol | 62.00439 ± 0.00090 | 133057-96-2*0 |
Oxadiazirine | [O(NN)]+ (g) | 1512.8 | 1510.3 | ± 2.8 | kJ/mol | 44.01233 ± 0.00033 | *227934-45-4*0 |
Dioxymethylidyne cation | [COO]+ (g, doublet) | 1434.5 | 1437.8 | ± 3.7 | kJ/mol | 44.0090 ± 0.0010 | *791121-04-5*2 |
Peroxynitrous acid | HOONO (g) | -6.13 | -12.76 | ± 0.38 | kJ/mol | 63.01288 ± 0.00091 | 14691-52-2*0 |
Peroxyimidogen cation | [NOO]+ (g) | 1405.5 | 1402.7 | ± 3.8 | kJ/mol | 46.00499 ± 0.00060 | *60488-32-6*0 |
Acetic acid | CH3C(O)OH (g, anti) | -397.7 | -411.5 | ± 1.2 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*2 |
Hydrazine | H2NNH2 (cr,l) | 57.34 | 50.77 | ± 0.18 | kJ/mol | 32.04524 ± 0.00031 | 302-01-2*500 |
Acetic acid | CH3C(O)OH (aq, 1000 H2O) | | -484.81 | ± 0.25 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*839 |
Dioxymethylidyne cation | [(C)(OO)]+ (g, vdW quartet) | 1384.7 | 1389.0 | ± 5.6 | kJ/mol | 44.0090 ± 0.0010 | *791121-04-5*101 |
Hydrochlorate ion | [HCl]- (g) | -25.5 | -24.5 | ± 3.0 | kJ/mol | 36.46119 ± 0.00090 | 63099-75-2*0 |
Nitric acid monohydrate | HNO3(H2O) (cr,l) | -479.13 | -472.64 | ± 0.19 | kJ/mol | 81.0282 ± 0.0012 | 13444-82-1*500 |
1-Ethenylium-1-yl | [CCH2]+ (g) | 1508.6 | 1509.0 | ± 2.7 | kJ/mol | 26.0367 ± 0.0016 | 80541-07-7*0 |
Methyl formate | HC(O)OCH3 (l) | | -386.15 | ± 0.59 | kJ/mol | 60.0520 ± 0.0017 | 107-31-3*500 |
Ethylene glycol | (CH2OH)2 (cr,l) | -448.68 | -455.20 | ± 0.38 | kJ/mol | 62.0678 ± 0.0018 | 107-21-1*500 |
Carbon dioxide cation | [CO2]+ (g, quartet) | 1327.1 | 1328.0 | ± 3.2 | kJ/mol | 44.0090 ± 0.0010 | 12181-61-2*1 |
Nitric acid | HNO3 (aq, 1 H2O) | | -186.81 | ± 0.19 | kJ/mol | 63.01288 ± 0.00091 | 7697-37-2*801 |
Oxalic acid | (COOH)2 (cr) | | -819.28 | ± 0.47 | kJ/mol | 90.0349 ± 0.0020 | 144-62-7*500 |
Hydrazoic acid anion | [HNNN]- (g) | 317.4 | 311.0 | ± 2.5 | kJ/mol | 43.02871 ± 0.00022 | 203264-98-6*0 |
Dimethylamine | (CH3)2NH (l) | | -41.10 | ± 0.73 | kJ/mol | 45.0837 ± 0.0017 | 124-40-3*500 |
Trimethylamine | (CH3)3N (l) | | -45.74 | ± 0.62 | kJ/mol | 59.1103 ± 0.0025 | 75-50-3*500 |
Cyanogen cation | [NCCN]+ (g) | 1598.26 | 1600.49 | ± 0.44 | kJ/mol | 52.0343 ± 0.0016 | 37354-81-7*0 |
Cyanogen anion | [NCCN]- (g) | 281.4 | 284.5 | ± 2.7 | kJ/mol | 52.0354 ± 0.0016 | 11118-88-0*0 |
Isocyanogen cation | [CNCN]+ (g) | 1652.8 | 1654.1 | ± 1.7 | kJ/mol | 52.0343 ± 0.0016 | 133415-63-1*0 |
Diisocyanogen anion | [CNNC]- (g) | 456.7 | 463.6 | ± 5.7 | kJ/mol | 52.0354 ± 0.0016 | *78800-22-3*0 |
Diazoethenylidene cation | [NNCC]+ (g) | 1777.0 | 1779.1 | ± 6.1 | kJ/mol | 52.0343 ± 0.0016 | *130760-10-0*0 |
Diazoethenylidene anion | [NNCC]- (g) | 536.0 | 538.5 | ± 5.8 | kJ/mol | 52.0354 ± 0.0016 | *130760-11-1*0 |
3H-diazirin-3-ylidene-methylene | CC(NN) (g) | 833.6 | 836.0 | ± 3.6 | kJ/mol | 52.0349 ± 0.0016 | 204253-88-3*0 |
Carbon monoxide anion | [CO]- (g) | 39.1 | 42.4 | ± 3.1 | kJ/mol | 28.01065 ± 0.00085 | 12539-63-8*0 |
Isocyanomethyliumylidene | [CNC]+ (g) | 1612.1 | 1617.7 | ± 6.2 | kJ/mol | 38.0276 ± 0.0016 | 78271-45-1*0 |
Isocyanomethylidyne anion | [CNC]- (g) | 478.1 | 481.8 | ± 5.9 | kJ/mol | 38.0287 ± 0.0016 | *53590-27-5*0 |
Cyanomethyliumylidene | [CCN]+ (g) | 1710.1 | 1715.6 | ± 6.3 | kJ/mol | 38.0276 ± 0.0016 | 76619-90-4*0 |
Cyanomethylidyne anion | [CCN]- (g) | 405.6 | 409.3 | ± 6.0 | kJ/mol | 38.0287 ± 0.0016 | 12373-35-2*0 |
2,3-didehydro-1H-azirin-1-yl | N(CC) (g) | 721.4 | 725.5 | ± 5.1 | kJ/mol | 38.0281 ± 0.0016 | 439586-06-8*0 |
Cyanoaminyliumyl | [NCN]+ (g) | 1660.9 | 1662.3 | ± 6.0 | kJ/mol | 40.02363 ± 0.00081 | 316122-03-9*0 |
Cyanoamidogen anion | [NCN]- (g) | 205.7 | 205.7 | ± 1.8 | kJ/mol | 40.02473 ± 0.00081 | 189879-95-6*0 |
Diazomethyliumyl | [CNN]+ (g) | 1636.6 | 1638.3 | ± 6.1 | kJ/mol | 40.02363 ± 0.00081 | 307495-90-5*0 |
Diazomethylene anion | [CNN]- (g) | 401.7 | 401.9 | ± 3.3 | kJ/mol | 40.02473 ± 0.00081 | 205498-92-6*0 |
3H-Diazirin-3-ylidene | C(NN) (g) | 580.2 | 580.6 | ± 4.4 | kJ/mol | 40.02418 ± 0.00081 | 253308-70-2*0 |
Ethynylene cation | [C2]+ (g) | 1968.3 | 1974.9 | ± 2.5 | kJ/mol | 24.0209 ± 0.0016 | 12595-79-8*0 |
Trifluorine | F3 (g) | 86.4 | 87.1 | ± 3.7 | kJ/mol | 56.9952096 ± 0.0000015 | 73455-86-4*0 |
Oxygen atom | O (g, singlet) | 436.666 | 438.523 | ± 0.002 | kJ/mol | 15.99940 ± 0.00030 | 17778-80-2*2 |
Carbide | [C2]- (g) | 504.90 | 511.48 | ± 0.54 | kJ/mol | 24.0219 ± 0.0016 | 12595-78-7*0 |
Trioxygen difluoride | FOOOF (g) | 116.8 | 111.3 | ± 7.8 | kJ/mol | 85.99501 ± 0.00090 | 16829-28-0*0 |
Formaldehyde | H2CO (cr, paraformaldehyde) | | -179.2 | ± 1.6 | kJ/mol | 30.02598 ± 0.00087 | 50-00-0*500 |
Chlorosyl ion | [ClO]+ (g) | 1150.58 | 1150.42 | ± 0.79 | kJ/mol | 51.45155 ± 0.00095 | 12301-79-0*0 |
Methylene chloride | CH2Cl2 (l) | | -123.27 | ± 0.61 | kJ/mol | 84.9320 ± 0.0020 | 75-09-2*590 |
Chlorine fluoride cation | [ClF]+ (g) | 1165.45 | 1165.64 | ± 0.64 | kJ/mol | 54.45055 ± 0.00090 | 12432-44-9*0 |
Hydroxylamine | NH2OH (aq, undissoc) | | -97.1 | ± 2.2 | kJ/mol | 33.02996 ± 0.00037 | 7803-49-8*1000 |
Azide ion | [N3]- (aq) | | 272.76 | ± 0.53 | kJ/mol | 42.02077 ± 0.00021 | 14343-69-2*800 |
1,2-Propadien-1-ylium-1-yl-3-ylidene | [CCC]+ (g, lin only) | 1974.0 | 1982.7 | ± 3.0 | kJ/mol | 36.0316 ± 0.0024 | 118090-85-0*1 |
Fluorosyl fluoride cation | [FFO]+ (g) | 1409.3 | 1409.6 | ± 6.3 | kJ/mol | 53.99566 ± 0.00030 | *86825-50-5*0 |
Ethanide | [CH3CH2]- (g) | 156.3 | 144.6 | ± 2.5 | kJ/mol | 29.0616 ± 0.0016 | 25013-41-6*0 |
Hydrogen chloride | HCl (aq, 3000 H2O) | | -166.743 | ± 0.024 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*842 |
Hexafluoroethane | CF3CF3 (g) | -1342.2 | -1350.5 | ± 1.7 | kJ/mol | 138.0118 ± 0.0016 | 76-16-4 |
Hydrazide | [N2H3]- (g) | 252.9 | 243.0 | ± 2.5 | kJ/mol | 31.03785 ± 0.00025 | 25415-88-7*0 |
Ethane cation | [C2H6]+ (g) | 1043.49 | 1029.94 | ± 0.63 | kJ/mol | 30.0685 ± 0.0017 | 34488-65-8*0 |
Difluoromethylene anion | [CF2]- (g) | -211.12 | -209.90 | ± 0.63 | kJ/mol | 50.00805 ± 0.00080 | 66212-40-6*0 |
Methylamine | CH3NH2 (l) | | -44.69 | ± 0.58 | kJ/mol | 31.05714 ± 0.00088 | 74-89-5*500 |
Fluoromethylidyne anion | [CF]- (g) | 200.6 | 204.1 | ± 2.1 | kJ/mol | 31.00965 ± 0.00080 | 33412-12-3*0 |
Dihydrogen cation | [H2]+ (g, ortho) | 1489.060 | 1488.480 | ± 0.000 | kJ/mol | 2.01533 ± 0.00014 | 12184-90-6*1 |
Iodine atom | I (g, 2P3/2 only) | 107.157 | 106.757 | ± 0.002 | kJ/mol | 126.904470 ± 0.000030 | 14362-44-8*1 |
Hydrofluorate ion | [HF]- (g) | -74.4 | -73.9 | ± 2.7 | kJ/mol | 20.006892 ± 0.000070 | 37249-79-9*0 |
Deuterium atom cation | D+ (g) | 1532.211 | 1534.123 | ± 0.000 | kJ/mol | 2.01355319809 ± 0.00000000040 | 14464-47-2*0 |
Dibromine monoxide | BrBrO (g) | 180.7 | 164.9 | ± 2.2 | kJ/mol | 175.8074 ± 0.0020 | 68322-97-4*0 |
1,2-Difluoroacetylene cation | [FCCF]+ (g) | 1078.7 | 1081.7 | ± 2.0 | kJ/mol | 62.0177 ± 0.0016 | 268566-70-7*0 |
Hydrogen fluoride | HF (aq, 400 H2O) | | -321.50 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*832 |
Ammonia anion | [NH3]- (g) | 38.3 | 31.4 | ± 2.8 | kJ/mol | 17.03111 ± 0.00022 | *76211-32-0*0 |
Deuterium hydride cation | [HD]+ (g) | 1490.498 | 1490.587 | ± 0.000 | kJ/mol | 3.021493 ± 0.000070 | 12181-16-7*0 |
Methane anion | [CH4]- (g) | 10.4 | 3.1 | ± 4.2 | kJ/mol | 16.04301 ± 0.00085 | 27680-53-1*0 |
Nitric acid | HNO3 (aq, 3 H2O) | | -197.72 | ± 0.19 | kJ/mol | 63.01288 ± 0.00091 | 7697-37-2*805 |
Dioxofluorine | OFO (g) | 522.96 | 521.22 | ± 0.90 | kJ/mol | 50.99720 ± 0.00060 | 175861-93-5*0 |
Oxygen difluoride cation | [FOF]+ (g) | 1292.20 | 1289.68 | ± 0.67 | kJ/mol | 53.99566 ± 0.00030 | 39432-25-2*0 |
Fluorosyl fluoride anion | [FFO]- (g) | -53.5 | -53.0 | ± 6.1 | kJ/mol | 53.99675 ± 0.00030 | *86825-57-2*0 |
1-Ethylium-1-ylidene | [CH3C]+ (g) | 1329.8 | 1326.7 | ± 2.8 | kJ/mol | 27.0447 ± 0.0016 | 78949-84-5*0 |
2-Iodoethanol | ICH2CH2OH (l) | | -207.2 | ± 2.4 | kJ/mol | 171.9650 ± 0.0017 | 624-76-0*590 |
1,3-Butadiyne cation | [HCCCCH]+ (g) | 1440.67 | 1441.52 | ± 0.89 | kJ/mol | 50.0581 ± 0.0032 | 55468-55-8*0 |
Deuterium hydride | HD (g) | 0.328 | 0.319 | ± 0.000 | kJ/mol | 3.022042 ± 0.000070 | 13983-20-5*0 |
Tricarbon dioxide cation | [OCCCO]+ (g) | 925.4 | 929.0 | ± 1.5 | kJ/mol | 68.0304 ± 0.0025 | 151528-67-5*0 |
Tricarbon dioxide anion | [OCCCO]- (g) | -133.1 | -129.4 | ± 3.0 | kJ/mol | 68.0314 ± 0.0025 | 109362-94-9 |
Benzene anion | [C6H6]- (g) | 211.6 | 199.3 | ± 3.7 | kJ/mol | 78.1124 ± 0.0048 | 34562-85-1*0 |
Hydrogen bromide | HBr (aq, 1000 H2O) | | -120.60 | ± 0.15 | kJ/mol | 80.9119 ± 0.0010 | 10035-10-6*839 |
o-Benzyne cation | [C6H4]+ (g) | 1398.9 | 1391.4 | ± 3.0 | kJ/mol | 76.0954 ± 0.0048 | 70220-84-7*0 |
Methylene anion | [CH2]- (g) | 328.28 | 328.72 | ± 0.55 | kJ/mol | 14.02713 ± 0.00081 | 50928-07-9*0 |
Toluene | C6H5CH3 (g) | 73.69 | 50.41 | ± 0.37 | kJ/mol | 92.1384 ± 0.0056 | 108-88-3*0 |
Toluene | C6H5CH3 (l) | 20.12 | 12.36 | ± 0.36 | kJ/mol | 92.1384 ± 0.0056 | 108-88-3*500 |
Iodine monochloride | ICl (cr) | -36.511 | -35.537 | ± 0.063 | kJ/mol | 162.35717 ± 0.00090 | 7790-99-0*510 |
Nitrogen sesquioxide cation | [ONNO2]+ (g) | 1031.0 | 1027.6 | ± 4.1 | kJ/mol | 76.01113 ± 0.00091 | *10544-73-7*0 |
Methanol | CH3OH (l) | -235.06 | -238.40 | ± 0.18 | kJ/mol | 32.04186 ± 0.00090 | 67-56-1*500 |
Dioxygen difluoride anion | [FOOF]- (g) | -235.6 | -235.8 | ± 5.6 | kJ/mol | 69.99615 ± 0.00060 | *7783-45-1*0 |
Iodobenzene cation | [C6H5I]+ (g) | 1022.9 | 1007.4 | ± 1.1 | kJ/mol | 204.0078 ± 0.0048 | 38406-85-8*0 |
Hydrogen chloride | HCl (aq, 200 H2O) | | -166.106 | ± 0.024 | kJ/mol | 36.46064 ± 0.00090 | 7647-01-0*830 |
Nitrosobenzene | C6H5NO (g) | 215.6 | 198.6 | ± 1.5 | kJ/mol | 107.1100 ± 0.0048 | 586-96-9*0 |
n-Hexane | C6H14 (l) | -179.83 | -198.49 | ± 0.48 | kJ/mol | 86.1754 ± 0.0049 | 110-54-3*500 |
2-Butyne | (CH3)CC(CH3) (g) | 158.72 | 145.76 | ± 0.79 | kJ/mol | 54.0904 ± 0.0032 | 503-17-3 |
1-Butene | CH2CHCH2CH3 (g) | 20.92 | -0.03 | ± 0.48 | kJ/mol | 56.1063 ± 0.0032 | 106-98-9 |
cis-2-Butene | CH3CHCHCH3 (g) | 13.94 | -7.33 | ± 0.53 | kJ/mol | 56.1063 ± 0.0032 | 590-18-1 |
trans-2-Butene | CH3CHCHCH3 (g) | 9.38 | -11.18 | ± 0.51 | kJ/mol | 56.1063 ± 0.0032 | 624-64-6 |
Isobutene | CH2C(CH3)2 (g) | 3.46 | -17.60 | ± 0.53 | kJ/mol | 56.1063 ± 0.0032 | 115-11-7 |
Carbon dioxide cation | [CO2]+ (g) | 936.102 | 936.937 | ± 0.023 | kJ/mol | 44.0090 ± 0.0010 | 12181-61-2*0 |
Hydrogen fluoride | HF (aq, 18.5 H2O) | | -321.06 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*887 |
2-Propynylium | [CH2CCH]+ (g) | 1190.95 | 1188.05 | ± 0.48 | kJ/mol | 39.0554 ± 0.0024 | 21540-27-2*0 |
Heptane | C7H16 (l) | -201.45 | -223.91 | ± 0.74 | kJ/mol | 100.2019 ± 0.0057 | 142-82-5*500 |
Octane | C8H18 (l) | -226.61 | -249.73 | ± 0.79 | kJ/mol | 114.2285 ± 0.0065 | 111-65-9*500 |
2,2,4-Trimethylpentane | (CH3)2CHCH2C(CH3)3 (l) | -224.4 | -258.8 | ± 1.5 | kJ/mol | 114.2285 ± 0.0065 | 540-84-1*500 |
Trifluoroethylene | C2HF3 (g) | -482.8 | -487.8 | ± 8.4 | kJ/mol | 82.0245 ± 0.0016 | 359-11-5 |
Difluorovinylidene | CH2CF2 (g) | -326.0 | -332.9 | ± 2.4 | kJ/mol | 64.0341 ± 0.0016 | 75-38-7 |
Norbornadiene | (CHCH)CHCH2CH(CHCH) (g) | 237.9 | 212.5 | ± 1.2 | kJ/mol | 92.1384 ± 0.0056 | 121-46-0*0 |
Norbornadiene | (CHCH)CHCH2CH(CHCH) (l) | | 179.13 | ± 1.02 | kJ/mol | 92.1384 ± 0.0056 | 121-46-0*500 |
2,3-Butanedione | (CH3CO)2 (cr,l) | | -365.47 | ± 0.55 | kJ/mol | 86.0892 ± 0.0033 | 431-03-8*500 |
2,3-Butanedione | (CH3CO)2 (g) | -309.97 | -326.54 | ± 0.82 | kJ/mol | 86.0892 ± 0.0033 | 431-03-8*0 |
Succinic acid | (CH2COOH)2 (cr,l) | -918.54 | -940.26 | ± 0.13 | kJ/mol | 118.0880 ± 0.0034 | 110-15-6*500 |
1,2-Difluoroethane | (CFH2)2 (g) | -437.0 | -450.4 | ± 5.1 | kJ/mol | 66.0500 ± 0.0016 | 624-72-6 |
Formic acid | HC(O)OH (cr,l) | -431.64 | -424.81 | ± 0.22 | kJ/mol | 46.0254 ± 0.0010 | 64-18-6*500 |
1,2-Diiodoethane | (CIH2)2 (g) | 87.79 | 73.12 | ± 0.90 | kJ/mol | 281.8621 ± 0.0016 | 624-73-7*0 |
1,2-Diiodoethane | (CIH2)2 (cr,l) | | 9.26 | ± 0.60 | kJ/mol | 281.8621 ± 0.0016 | 624-73-7*500 |
Ethylidyne anion | [CH3C]- (g) | 459.1 | 454.9 | ± 2.8 | kJ/mol | 27.0458 ± 0.0016 | 117768-70-4*0 |
1-Propynylium | [CH3CC]+ (g) | 1538. | 1536. | ± 16. | kJ/mol | 39.0554 ± 0.0024 | 24858-94-4*0 |
1,1-Dibromoethane | CHBr2CH3 (g) | -9.3 | -36.3 | ± 7.8 | kJ/mol | 187.8612 ± 0.0026 | 557-91-5*0 |
Xenon hydride cation | [XeH]+ (g) | 1038.37 | 1036.60 | ± 0.94 | kJ/mol | 132.2974 ± 0.0200 | 37276-91-8 |
Bromine atom | Br (g, 2P3/2 only) | 117.914 | 111.852 | ± 0.056 | kJ/mol | 79.9040 ± 0.0010 | 10097-32-2*1 |
Bromodioxy | BrOO (g) | 119.3 | 110.2 | ± 4.0 | kJ/mol | 111.9028 ± 0.0012 | 67177-47-3*0 |
Hydrazine monohydrate | (H2NNH2)(H2O) (l) | | -242.57 | ± 0.19 | kJ/mol | 50.06052 ± 0.00053 | 7803-57-8*500 |
Iodine monochloride | ICl (l) | | -24.048 | ± 0.063 | kJ/mol | 162.35717 ± 0.00090 | 7790-99-0*590 |
Hydroxymethylene | HCOH (g) | 111.96 | 108.20 | ± 0.43 | kJ/mol | 30.02598 ± 0.00087 | 19710-56-6*0 |
Acetaldehyde | CH3CHO (cr,l) | -186.88 | -191.59 | ± 0.36 | kJ/mol | 44.0526 ± 0.0017 | 75-07-0*500 |
Deuterium molecule cation | [D2]+ (g) | 1492.286 | 1492.361 | ± 0.000 | kJ/mol | 4.02765497609 ± 0.00000000080 | 12184-84-8*0 |
Hydroxylamine | NH2OH (g) | -33.12 | -43.48 | ± 0.49 | kJ/mol | 33.02996 ± 0.00037 | 7803-49-8*0 |
1,2-Propadien-1-yl-3-ylidene anion | [CCC]- (g) | 622.2 | 629.6 | ± 1.7 | kJ/mol | 36.0326 ± 0.0024 | 109292-47-9*0 |
Trihydrogen cation | [H3]+ (g, para) | 1110.304 | 1106.697 | ± 0.013 | kJ/mol | 3.02327 ± 0.00021 | 28132-48-1*2 |
Hydrogen peroxide | H2O2 (cr,l) | -193.148 | -187.327 | ± 0.081 | kJ/mol | 34.01468 ± 0.00062 | 7722-84-1*500 |
Deuteride | D- (g) | 146.991 | 148.904 | ± 0.002 | kJ/mol | 2.01465035791 ± 0.00000000040 | 14452-69-8*0 |
Iodine atom | I (g, 2P1/2 only) | 198.109 | 197.709 | ± 0.002 | kJ/mol | 126.904470 ± 0.000030 | 14362-44-8*2 |
Ethyl bromide | CH3CH2Br (l) | -55.59 | -91.12 | ± 0.29 | kJ/mol | 108.9651 ± 0.0019 | 74-96-4*500 |
Hydrogen fluoride | HF (aq, 45 H2O) | | -321.18 | ± 0.17 | kJ/mol | 20.006343 ± 0.000070 | 7664-39-3*906 |
Vinyl iodide | CH2CHI (g) | 139.4 | 130.6 | ± 1.2 | kJ/mol | 153.9497 ± 0.0016 | 593-66-8 |
Oxygen fluoride | OOF2 (g) | 75.5 | 71.3 | ± 7.8 | kJ/mol | 69.99561 ± 0.00060 | 183051-89-0*0 |
Diatomic bromine cation | [Br2]+ (g) | 1060.33 | 1045.38 | ± 0.23 | kJ/mol | 159.8075 ± 0.0020 | 12595-71-0*0 |
Difluorine cation | [F2]+ (g) | 1514.301 | 1514.475 | ± 0.012 | kJ/mol | 37.9962578 ± 0.0000010 | 12184-86-0*0 |
Tribromide ion | [Br3]- (aq) | | -129.57 | ± 0.25 | kJ/mol | 239.7125 ± 0.0030 | 14522-80-6*800 |
Acetic acid | CH3C(O)OH (aq, 500 H2O) | | -484.79 | ± 0.25 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*833 |
Tetraazatetrahedrane | N4 (g) | 763.9 | 757.4 | ± 1.7 | kJ/mol | 56.02696 ± 0.00028 | 12596-63-3*0 |
Dihydrogen cation | [H2]+ (g, para) | 1488.364 | 1488.480 | ± 0.000 | kJ/mol | 2.01533 ± 0.00014 | 12184-90-6*2 |
Acetic acid | CH3C(O)OH (aq, 10000 H2O) | | -484.84 | ± 0.25 | kJ/mol | 60.0520 ± 0.0017 | 64-19-7*850 |
Trioxirane | O(OO) (g) | 275.1 | 272.5 | ± 1.6 | kJ/mol | 47.99820 ± 0.00090 | 153851-84-4*0 |
Carbon atom | C (g, triplet only) | 711.388 | 716.873 | ± 0.057 | kJ/mol | 12.01070 ± 0.00080 | 7440-44-0*1 |
Tetrazete | N4 (g) | 769.6 | 763.6 | ± 2.4 | kJ/mol | 56.02696 ± 0.00028 | 42851-09-2*0 |
Tricarbon dioxide | OCCCO (cr,l) | -134.5 | -119.4 | ± 1.4 | kJ/mol | 68.0309 ± 0.0025 | 504-64-3*500 |
Hydrogen iodide | HI (aq) | | -56.824 | ± 0.090 | kJ/mol | 127.912410 ± 0.000076 | 10034-85-2*800 |
Chlorine atom | Cl (g, 2P3/2 only) | 119.621 | 121.228 | ± 0.002 | kJ/mol | 35.45270 ± 0.00090 | 22537-15-1*1 |
Tetrabromomethane | CBr4 (cr, monoclinic) | | 47.5 | ± 1.3 | kJ/mol | 331.6267 ± 0.0041 | 558-13-4*500 |
Tetraiodomethane | CI4 (cr, monoclinic) | | 392.5 | ± 8.0 | kJ/mol | 519.62858 ± 0.00081 | 507-25-5*500 |
Ammonium hydroxide | NH4OH (aq, undissoc) | | -366.715 | ± 0.062 | kJ/mol | 35.04584 ± 0.00047 | 1336-21-6*1000 |
Fluorine atom | F (g, 2P3/2 only) | 77.268 | 79.053 | ± 0.057 | kJ/mol | 18.99840320 ± 0.00000050 | 14762-94-8*1 |
Formaldehyde | H2CO (aq) | | -171.14 | ± 0.59 | kJ/mol | 30.02598 ± 0.00087 | 50-00-0*800 |
Methyl bromide | CH3Br (l) | -56.71 | -59.72 | ± 0.20 | kJ/mol | 94.9385 ± 0.0013 | 74-83-9*590 |
Cyanamide | H2NCN (cr) | | 58.84 | ± 0.55 | kJ/mol | 42.04006 ± 0.00082 | 420-04-2*500 |
1-Butyne | CH3CH2CCH (g) | 178.97 | 165.39 | ± 0.85 | kJ/mol | 54.0904 ± 0.0032 | 107-00-6 |
Cyclobutene | C4H6 (g) | 173.9 | 156.9 | ± 1.6 | kJ/mol | 54.0904 ± 0.0032 | 822-35-5 |
Dihydrogen | H2 (g, ortho) | 1.417 | 0.019 | ± 0.000 | kJ/mol | 2.01588 ± 0.00014 | 1333-74-0*1 |
1-Hydroxyethyl | CH3CHOH (g) | -41.86 | -55.29 | ± 0.62 | kJ/mol | 45.0605 ± 0.0017 | 2348-46-1*0 |
2-Propanol | CH3CHOHCH3 (g) | -248.70 | -272.80 | ± 0.37 | kJ/mol | 60.0950 ± 0.0025 | 67-63-0*0 |
1,2-Propadien-1-ylium-1-yl-3-ylidene | [CCC]+ (g) | 1953.8 | 1960.9 | ± 2.2 | kJ/mol | 36.0316 ± 0.0024 | 118090-85-0*0 |
(Z)-1,2-Diiodoethene | C2H2I2 (g) | 215.76 | 207.48 | ± 0.45 | kJ/mol | 279.8462 ± 0.0016 | 590-26-1 |
(E)-1,2-Diiodoethene | C2H2I2 (g) | 214.87 | 207.48 | ± 0.45 | kJ/mol | 279.8462 ± 0.0016 | 590-27-2 |
1,3-Cyclopentadiene | C5H6 (g) | 118.2 | 101.3 | ± 2.5 | kJ/mol | 66.1011 ± 0.0040 | 542-92-7 |
Formaldehyde | H2CO (cr, polyoxymethylene) | | -170.88 | ± 0.21 | kJ/mol | 30.02598 ± 0.00087 | 50-00-0*501 |
Hydroxylamine | NH2OH (cr,l) | | -107.50 | ± 0.65 | kJ/mol | 33.02996 ± 0.00037 | 7803-49-8*500 |
1,2-Dibromoethane | (CBrH2)2 (cr,l) | | -79.3 | ± 1.3 | kJ/mol | 187.8612 ± 0.0026 | 106-93-4*500 |
Xenon cation | Xe+ (g) | 1170.354 | 1170.354 | ± 0.006 | kJ/mol | 131.2895 ± 0.0200 | 24203-25-6*0 |
Hydrazoic acid | HNNN (aq, undissoc) | | 257.79 | ± 0.54 | kJ/mol | 43.02816 ± 0.00022 | 7782-79-8*1000 |
Hydrazoic acid | HNNN (aq) | | 272.76 | ± 0.53 | kJ/mol | 43.02816 ± 0.00022 | 7782-79-8*800 |
Krypton hydride cation | [KrH]+ (g) | 1106.49 | 1104.71 | ± 0.70 | kJ/mol | 84.8074 ± 0.1000 | 37276-90-7 |
Nitrogen atom anion | N- (g) | 489.2 | 491.5 | ± 4.2 | kJ/mol | 14.007289 ± 0.000070 | 17778-87-9*0 |
Oxirene | O(CHCH) (g) | 276.6 | 275.9 | ± 3.1 | kJ/mol | 42.0367 ± 0.0016 | 157-18-6*0 |
Dioxygen difluoride cation | [FOOF]+ (g) | 1292.9 | 1289.7 | ± 4.7 | kJ/mol | 69.99506 ± 0.00060 | *7783-44-0*0 |
Phosgene | COCl2 (cr,l, I+liquid) | | -242.63 | ± 0.28 | kJ/mol | 98.9155 ± 0.0020 | 75-44-5*501 |
Phosgene | COCl2 (cr,l, II+liquid) | -255.33 | -242.63 | ± 0.28 | kJ/mol | 98.9155 ± 0.0020 | 75-44-5*502 |
Oxirene | O(CHCH) (g, triplet) | 389.9 | 386.6 | ± 2.8 | kJ/mol | 42.0367 ± 0.0016 | 157-18-6*1 |
Nitrosyl nitrite anion | [ONONO]- (g) | -100.8 | -104.0 | ± 4.4 | kJ/mol | 76.01223 ± 0.00091 | *122413-35-8*0 |
Diisocyanogen cation | [CNNC]+ (g, trans-cis equilib) | 1823.0 | 1826.0 | ± 3.5 | kJ/mol | 52.0343 ± 0.0016 | *78800-21-2*0 |
2-Hydroxyethylium | [CH2CH2OH]+ (g) | 1019.7 | 1007.6 | ± 1.7 | kJ/mol | 45.0600 ± 0.0017 | 38607-31-7*0 |
Cyanogen | NCCN (cr,l) | 273.91 | 289.16 | ± 0.44 | kJ/mol | 52.0349 ± 0.0016 | 460-19-5*500 |
cis-Dinitrogen dioxide | ONNO (g, cis) | 172.82 | 171.06 | ± 0.14 | kJ/mol | 60.01228 ± 0.00062 | 57932-56-6*0 |
Vinyl alcohol | CH2CHOH (g, syn-anti equilib) | -112.40 | -122.77 | ± 0.91 | kJ/mol | 44.0526 ± 0.0017 | 557-75-5*0 |
Acetylene anion | [HCCH]- (g) | 359.5 | 359.3 | ± 3.0 | kJ/mol | 26.0378 ± 0.0016 | 50443-89-5*0 |
2-Iodoethanol | ICH2CH2OH (g) | -132.0 | -150.2 | ± 2.5 | kJ/mol | 171.9650 ± 0.0017 | 624-76-0*0 |
Dihydrogen | H2 (g, para) | 0.000 | -0.058 | ± 0.000 | kJ/mol | 2.01588 ± 0.00014 | 1333-74-0*2 |
Dioxygen | O2 (g, triplet only) | 0.000 | 0.000 | ± 0.000 | kJ/mol | 31.99880 ± 0.00060 | 7782-44-7*1 |
Vinyl alcohol cation | [CH2CHOH]+ (g, anti-syn equilib) | 779.3 | 768.4 | ± 1.3 | kJ/mol | 44.0520 ± 0.0017 | 57239-63-1*0 |
Diazene anion | [HNNH]- (g, trans-cis equilib) | 269.3 | 262.5 | ± 1.7 | kJ/mol | 30.02991 ± 0.00020 | 100429-75-2*1 |
Ethylidene | CH3CH (g) | 361.5 | 354.5 | ± 1.2 | kJ/mol | 28.0532 ± 0.0016 | 4218-50-2*0 |
Carbon atom | C (diamond) | 2.391 | 1.863 | ± 0.044 | kJ/mol | 12.01070 ± 0.00080 | 7440-44-0*501 |
Dihydrogen trioxide cation | [HOOOH]+ (g) | 928.9 | 920.2 | ± 1.9 | kJ/mol | 50.01353 ± 0.00091 | 161321-37-5*0 |
Bromine atom | Br (g, 2P1/2 only) | 161.998 | 155.936 | ± 0.056 | kJ/mol | 79.9040 ± 0.0010 | 10097-32-2*2 |
Diazene anion | [HNNH]- (g, trans-cis-iso equilib) | 269.3 | 262.5 | ± 1.7 | kJ/mol | 30.02991 ± 0.00020 | 100429-75-2*0 |
Imidogen | NH (g, triplet only) | 358.74 | 358.79 | ± 0.17 | kJ/mol | 15.014680 ± 0.000099 | 13774-92-0*1 |
Iodine monochloride | ICl (cr,l) | -36.511 | -35.537 | ± 0.063 | kJ/mol | 162.35717 ± 0.00090 | 7790-99-0*500 |
Ethyl chloride | CH3CH2Cl (cr,l) | -134.04 | -135.66 | ± 0.22 | kJ/mol | 64.5138 ± 0.0019 | 75-00-3*500 |
Methanediol | CH2(OH)2 (g) | -379.20 | -392.59 | ± 0.96 | kJ/mol | 48.0413 ± 0.0010 | 463-57-0*0 |
Isocyanogen fluoride | FNC (g) | 299.3 | 301.1 | ± 2.3 | kJ/mol | 45.01584 ± 0.00080 | 16992-26-0*0 |
Imidogen | NH (g, singlet) | 509.34 | 509.39 | ± 0.18 | kJ/mol | 15.014680 ± 0.000099 | 13774-92-0*2 |
Hydrotrioxy | HOOO (g, cis) | 64.8 | 59.9 | ± 1.1 | kJ/mol | 49.00614 ± 0.00090 | 12500-78-6*2 |
Oxonium | [H3O]+ (aq) | | -285.825 | ± 0.027 | kJ/mol | 19.02267 ± 0.00037 | 13968-08-6*800 |
Hydroxymethylene cation | [HCOH]+ (g) | 972.2 | 968.6 | ± 1.6 | kJ/mol | 30.02543 ± 0.00087 | 135395-06-1*0 |
Diazene | HNNH (g, trans-cis-iso equilib) | 207.36 | 200.22 | ± 0.56 | kJ/mol | 30.02936 ± 0.00020 | 3618-05-1*0 |
Isocyanogen anion | [CNCN]- (g, trans-cis equilib) | 383.9 | 388.0 | ± 2.5 | kJ/mol | 52.0354 ± 0.0016 | *83951-85-3*0 |
Fluorine atom | F (g, 2P1/2 only) | 82.103 | 83.888 | ± 0.057 | kJ/mol | 18.99840320 ± 0.00000050 | 14762-94-8*2 |
Hydroxyaminylium | [HNOH]+ (g) | 1020.2 | 1013.0 | ± 2.0 | kJ/mol | 32.02147 ± 0.00034 | 66097-71-0*0 |
Diazene cation | [HNNH]+ (g, trans-cis equilib) | 1132.59 | 1125.69 | ± 0.74 | kJ/mol | 30.02881 ± 0.00020 | 76986-17-9*1 |
Methyl fluoride cation | [CH3F]+ (g) | 980.71 | 973.20 | ± 0.66 | kJ/mol | 34.03237 ± 0.00083 | 59122-96-2*0 |
Methylene radical | CH2 (g) | 390.95 | 391.46 | ± 0.14 | kJ/mol | 14.02658 ± 0.00081 | 2465-56-7*0 |
C=O-C cation | [COC]+ (g) | 1575.9 | 1582.9 | ± 2.3 | kJ/mol | 40.0203 ± 0.0016 | 83483-98-1*0 |
Chlorine atom | Cl (g, 2P1/2 only) | 130.177 | 131.783 | ± 0.002 | kJ/mol | 35.45270 ± 0.00090 | 22537-15-1*2 |
COC vdW | (CO)(C) (g) | 589.0 | 597.7 | ± 1.8 | kJ/mol | 40.0208 ± 0.0016 | *12071-24-8*0 |
Cyanogen chloride cation | [ClCN]+ (g) | 1325.81 | 1327.14 | ± 0.97 | kJ/mol | 61.4696 ± 0.0012 | 37612-72-9*0 |
Methyl fluoride | CH3F (l) | | -246.85 | ± 0.50 | kJ/mol | 34.03292 ± 0.00083 | 593-53-3*590 |
Methyl chloride cation | [CH3Cl]+ (g) | 1013.86 | 1006.41 | ± 0.41 | kJ/mol | 50.4867 ± 0.0012 | 12538-71-5*0 |
Methyl chloride | CH3Cl (l) | -106.48 | -102.51 | ± 0.21 | kJ/mol | 50.4872 ± 0.0012 | 74-87-3*590 |
Methyl bromide cation | [CH3Br]+ (g) | 996.13 | 981.21 | ± 0.19 | kJ/mol | 94.9380 ± 0.0013 | 12538-70-4*0 |
3-Chloro-3-methyl-3H-diazirine | (NNC)ClCH3 (g) | 230. | 218. | ± 40. | kJ/mol | 90.5114 ± 0.0019 | 4222-21-3 |
n-Hexane | C6H14 (g) | -130.07 | -166.94 | ± 0.48 | kJ/mol | 86.1754 ± 0.0049 | 110-54-3*0 |
Dinitrogen tetraoxide | O2NNO2 (cr,l) | -37.96 | -27.10 | ± 0.18 | kJ/mol | 92.0111 ± 0.0012 | 10544-72-6*500 |
Dichlorine cation | [Cl2]+ (g) | 1107.90 | 1107.87 | ± 0.22 | kJ/mol | 70.9049 ± 0.0018 | 12595-90-3*0 |
Methyl iodide cation | [CH3I]+ (g) | 944.78 | 935.38 | ± 0.18 | kJ/mol | 141.93844 ± 0.00083 | 12538-72-6*0 |
Dicarbon monoxide | CCO (g) | 374.8 | 378.9 | ± 1.3 | kJ/mol | 40.0208 ± 0.0016 | 12071-23-7*0 |
Iodosyl ion | [IO]+ (g) | 1066.1 | 1064.1 | ± 2.0 | kJ/mol | 142.90332 ± 0.00030 | 81182-81-2*0 |
Fluoroform | CF3H (l) | | -704.31 | ± 0.57 | kJ/mol | 70.01385 ± 0.00080 | 75-46-7*590 |
Hydroxyformyl | HOCO (g, trans-cis equilib) | -181.39 | -183.97 | ± 0.55 | kJ/mol | 45.0174 ± 0.0010 | 2564-86-5*0 |
Isocyanogen chloride | ClNC (g) | 314.8 | 316.6 | ± 2.5 | kJ/mol | 61.4701 ± 0.0012 | 75754-69-7*0 |
Hydrazoic acid | HNNN (cr,l) | | 261.70 | ± 0.72 | kJ/mol | 43.02816 ± 0.00022 | 7782-79-8*500 |
Oxygen atom | O (g, triplet only) | 246.844 | 249.229 | ± 0.002 | kJ/mol | 15.99940 ± 0.00030 | 17778-80-2*1 |
2-Cyclopropyn-1-ylidene | C(CC) (g) | 905.0 | 911.9 | ± 2.0 | kJ/mol | 36.0321 ± 0.0024 | 102508-15-6*0 |
Diiodine cation | [I2]+ (g) | 963.523 | 960.408 | ± 0.018 | kJ/mol | 253.808391 ± 0.000060 | 28712-14-3*0 |
Water | H2O (cr) | -286.297 | -292.738 | ± 0.027 | kJ/mol | 18.01528 ± 0.00033 | 7732-18-5*510 |
Cyclohexane | C6H12 (g) | -82.52 | -122.08 | ± 0.68 | kJ/mol | 84.1595 ± 0.0049 | 110-82-7 |
Hydroxymethylene anion | [HCOH]- (g) | 148.2 | 145.4 | ± 1.8 | kJ/mol | 30.02653 ± 0.00087 | 207914-87-2*0 |
Heptane | C7H16 (g) | -145.47 | -187.34 | ± 0.74 | kJ/mol | 100.2019 ± 0.0057 | 142-82-5*0 |
Iminomethyl | HCNH (g, trans-cis equilib) | 276.2 | 272.6 | ± 1.4 | kJ/mol | 28.03332 ± 0.00082 | 15691-95-9*0 |
Octane | C8H18 (g) | -161.39 | -208.22 | ± 0.79 | kJ/mol | 114.2285 ± 0.0065 | 111-65-9*0 |
Bromoform | CBr3H (l) | | 1.3 | ± 1.3 | kJ/mol | 252.7306 ± 0.0031 | 75-25-2*590 |
2,2,4-Trimethylpentane | (CH3)2CHCH2C(CH3)3 (g) | -171.3 | -223.7 | ± 1.5 | kJ/mol | 114.2285 ± 0.0065 | 540-84-1*0 |
Diazene | HNNH (g, trans-cis equilib) | 207.36 | 200.22 | ± 0.56 | kJ/mol | 30.02936 ± 0.00020 | 3618-05-1*1 |
Dinitrogen anion | [N2]- (g) | 196.0 | 196.0 | ± 2.2 | kJ/mol | 28.01403 ± 0.00014 | 12185-02-3*0 |
Dioxymethylene | HCOO (g, cis-trans equilib) | 332.1 | 329.9 | ± 5.9 | kJ/mol | 45.0174 ± 0.0010 | 438586-67-5*0 |
Nitrosyl nitrite | ONONO (g) | 91.2 | 86.6 | ± 1.6 | kJ/mol | 76.01168 ± 0.00091 | 122413-35-8*0 |
Hydrogen difluoride cation | [FHF]+ (g) | 1255. | 1251. | ± 20. | kJ/mol | 39.004198 ± 0.000070 | 126950-54-7*0 |
Dihydrogen trioxide | HOOOH (g) | -82.13 | -90.49 | ± 0.91 | kJ/mol | 50.01408 ± 0.00091 | 14699-99-1*0 |
Methylene fluoride | CH2F2 (l) | | -467.31 | ± 0.48 | kJ/mol | 52.02339 ± 0.00081 | 75-10-5*590 |
2-Hydroxyethyl | CH2CH2OH (g) | -12.55 | -25.82 | ± 0.61 | kJ/mol | 45.0605 ± 0.0017 | 4422-54-2*0 |
Cyanogen bromide cation | [BrCN]+ (g) | 1330.3 | 1324.0 | ± 1.2 | kJ/mol | 105.9209 ± 0.0013 | 34749-77-4*0 |
Hydrogen peroxide cation | [H2O2]+ (g) | 896.75 | 889.79 | ± 0.60 | kJ/mol | 34.01413 ± 0.00062 | 12325-10-9*0 |
Succinic acid | (CH2COOH)2 (g) | -795.62 | -817.76 | ± 0.61 | kJ/mol | 118.0880 ± 0.0034 | 110-15-6*0 |
Formic acid cation | [HC(O)OH]+ (g, syn-anti equilib) | 721.79 | 715.22 | ± 0.28 | kJ/mol | 46.0248 ± 0.0010 | 50614-05-6*0 |
Formic acid anion | [HC(O)OH]- (g, syn-anti equilib) | -254.5 | -260.7 | ± 2.3 | kJ/mol | 46.0259 ± 0.0010 | 19066-82-1*0 |
Trihydrogen cation | [H3]+ (g, ortho) | 1110.577 | 1106.695 | ± 0.013 | kJ/mol | 3.02327 ± 0.00021 | 28132-48-1*1 |
Hydroxyamidogen | HNOH (g) | 101.54 | 94.71 | ± 1.00 | kJ/mol | 32.02202 ± 0.00034 | 13940-32-4*0 |
Cyanogen fluoride cation | [FCN]+ (g) | 1293.8 | 1294.5 | ± 1.2 | kJ/mol | 45.01529 ± 0.00080 | 62532-69-8*0 |
Dihydrogen anion | [H2]- (g) | 317.0 | 317.9 | ± 3.1 | kJ/mol | 2.01643 ± 0.00014 | 12184-89-3*0 |
Fluoro(fluorooxy)methylene | FCOF (g) | -135.5 | -136.6 | ± 2.1 | kJ/mol | 66.00691 ± 0.00085 | 479587-30-9*0 |
Iminomethyl anion | [HCNH]- (g) | 239.0 | 235.3 | ± 2.0 | kJ/mol | 28.03387 ± 0.00082 | 90623-30-6*0 |
Trioxodinitrate anion | [ONNO2]- (g) | -103.0 | -106.9 | ± 2.9 | kJ/mol | 76.01223 ± 0.00091 | 194856-62-7*0 |
Hydrogen nitroxylate | [HONO]- (g) | -107.7 | -111.2 | ± 2.0 | kJ/mol | 47.01403 ± 0.00061 | 24388-53-2*0 |
Isocyanogen bromide | BrNC (g) | 344.2 | 338.5 | ± 3.7 | kJ/mol | 105.9214 ± 0.0013 | 65997-98-0*0 |
Diazene cation | [HNNH]+ (g, trans-iso-cis equilib) | 1132.59 | 1125.92 | ± 0.74 | kJ/mol | 30.02881 ± 0.00020 | 76986-17-9*0 |
Ethylene anion | [C2H4]- (g) | 236.8 | 230.3 | ± 2.3 | kJ/mol | 28.0537 ± 0.0016 | 34527-91-8*0 |
1,1-Dibromoethane | CHBr2CH3 (cr,l) | | -66.3 | ± 1.4 | kJ/mol | 187.8612 ± 0.0026 | 557-91-5*500 |
Hydroxyformyl anion | [HOCO]- (g, trans-cis equilib) | -320.4 | -322.4 | ± 1.2 | kJ/mol | 45.0180 ± 0.0010 | 78944-70-4*0 |
Ethylidyne | CH3C (g, doublet) | 512.7 | 508.6 | ± 1.4 | kJ/mol | 27.0452 ± 0.0016 | 67624-57-1*1 |
Helium cation | He+ (g) | 2372.322 | 2372.322 | ± 0.000 | kJ/mol | 4.0020534 ± 0.0000020 | 14234-48-1*0 |
Helium dication | [He]+2 (g) | 7622.839 | 7622.839 | ± 0.000 | kJ/mol | 4.0015048 ± 0.0000020 | 12587-46-1*0 |
Neon cation | Ne+ (g) | 2080.662 | 2080.769 | ± 0.001 | kJ/mol | 20.17915 ± 0.00060 | 14782-23-1*0 |
Argon cation | Ar+ (g) | 1520.571 | 1520.580 | ± 0.001 | kJ/mol | 39.9475 ± 0.0010 | 14791-69-6*0 |
Krypton cation | Kr+ (g) | 1350.759 | 1350.759 | ± 0.002 | kJ/mol | 83.7995 ± 0.1000 | 16915-28-9*0 |
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