Hydrogen
- Formula: H2
- Molecular weight: 2.01588
- IUPAC Standard InChIKey: UFHFLCQGNIYNRP-UHFFFAOYSA-N
- CAS Registry Number: 1333-74-0
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Isotopologues:
- Other names: Dihydrogen; o-Hydrogen; p-Hydrogen; Molecular hydrogen; H2; UN 1049; UN 1966
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- Other data available:
- Gas phase thermochemistry data
- Phase change data
- Reaction thermochemistry data: reactions 1 to 50, reactions 101 to 150, reactions 151 to 200, reactions 201 to 250, reactions 251 to 300, reactions 301 to 350, reactions 351 to 400, reactions 401 to 450, reactions 451 to 500, reactions 501 to 550, reactions 551 to 600, reactions 601 to 621
- Henry's Law data
- Gas phase ion energetics data
- Ion clustering data
- Mass spectrum (electron ionization)
- Constants of diatomic molecules
- Fluid Properties
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Reaction thermochemistry data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
MS - José A. Martinho Simões
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Reactions 51 to 100
By formula: 2H2 + C8H6 = C8H10
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -66.12 ± 0.06 | kcal/mol | Chyd | Davis, Allinger, et al., 1985 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -64.7 ± 0.9 | kcal/mol | Chyd | Rogers and McLafferty, 1971 | liquid phase; solvent: Hydrocarbon; ALS |
ΔrH° | -70.7 ± 1.0 | kcal/mol | Chyd | Flitcroft and Skinner, 1958 | liquid phase; ALS |
By formula: H2 + C6H12 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -27.75 ± 0.11 | kcal/mol | Chyd | Rogers, Crooks, et al., 1987 | liquid phase; ALS |
ΔrH° | -115.0 ± 0.83 | kcal/mol | Chyd | Rogers and Crooks, 1983 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -26.59 ± 0.27 | kcal/mol | Chyd | Rogers, Papadimetriou, et al., 1975 | liquid phase; solvent: Hexane; ALS |
By formula: H2 + C6H12 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -29.06 ± 0.076 | kcal/mol | Chyd | Rogers, Crooks, et al., 1987 | liquid phase; ALS |
ΔrH° | -28.52 ± 0.29 | kcal/mol | Chyd | Rogers, Papadimetriou, et al., 1975 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -28.57 ± 0.29 | kcal/mol | Chyd | Rogers and Siddiqui, 1975 | liquid phase; solvent: n-Hexane; ALS |
By formula: C6H12 + H2 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -28.18 ± 0.17 | kcal/mol | Chyd | Rogers, Crooks, et al., 1987 | liquid phase; ALS |
ΔrH° | -28.18 ± 0.20 | kcal/mol | Chyd | Rogers and Crooks, 1983 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -26.24 ± 0.41 | kcal/mol | Chyd | Rogers, Papadimetriou, et al., 1975 | liquid phase; solvent: Hexane; ALS |
By formula: H2 + C6H12 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -28.56 ± 0.16 | kcal/mol | Chyd | Rogers, Crooks, et al., 1987 | liquid phase; ALS |
ΔrH° | -28.44 ± 0.19 | kcal/mol | Chyd | Rogers and Crooks, 1983 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -27.05 ± 0.22 | kcal/mol | Chyd | Rogers, Papadimetriou, et al., 1975 | liquid phase; solvent: Hexane; ALS |
By formula: C7H8 + 2H2 = C7H12
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -70.8 ± 0.3 | kcal/mol | Chyd | Doering, Roth, et al., 1988 | gas phase; ALS |
ΔrH° | -69.77 ± 0.36 | kcal/mol | Chyd | Rogers, Choi, et al., 1980 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -68.11 ± 0.41 | kcal/mol | Chyd | Turner, Meador, et al., 1957 | liquid phase; solvent: Acetic acid; ALS |
By formula: H2 + C6H12 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -29.78 ± 0.13 | kcal/mol | Chyd | Rogers, Crooks, et al., 1987 | liquid phase; ALS |
ΔrH° | -30.06 ± 0.63 | kcal/mol | Chyd | Molnar, Rachford, et al., 1984 | liquid phase; solvent: Dioxane; ALS |
ΔrH° | -30.61 ± 0.44 | kcal/mol | Chyd | Molnar, Rachford, et al., 1984 | liquid phase; solvent: Hexane; ALS |
By formula: H2 + C7H14 = C7H16
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -29.3 ± 0.1 | kcal/mol | Chyd | Rogers and Dejroongruang, 1989 | liquid phase; solvent: Cyclohexane; ALS |
ΔrH° | -29.29 ± 0.10 | kcal/mol | Chyd | Dolliver, Gresham, et al., 1937 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -29.53 ± 0.15 kcal/mol; At 355 °K; ALS |
By formula: 2H2 + C10H16 = C10H20
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -51.4 ± 2.3 | kcal/mol | Chyd | Lopes, Nunes, et al., 1975 | liquid phase; solvent: Acetic acid; ALS |
ΔrH° | -53.62 ± 0.30 | kcal/mol | Chyd | Dolliver, Gresham, et al., 1937 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -54.11 ± 0.30 kcal/mol; At 355 °K; ALS |
By formula: H2 + C2H4O = C2H6O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -19.44 ± 0.34 | kcal/mol | Chyd | Wiberg, Crocker, et al., 1991 | liquid phase; solvent: Triglyme; ALS |
ΔrH° | -16.51 ± 0.10 | kcal/mol | Chyd | Dolliver, Gresham, et al., 1938 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -16.8 ± 0.1 kcal/mol; At 355 °K; ALS |
C39H68O3P2W (solution) + (solution) = C39H68O4P2W (solution) + (g)
By formula: C39H68O3P2W (solution) + H2O (solution) = C39H68O4P2W (solution) + H2 (g)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -2.80 ± 0.1 | kcal/mol | EqS | Kubas, Burns, et al., 1992 | solvent: Tetrahydrofuran; Temperature range: 203-298 K; MS |
C21H44O3P2W (solution) + (solution) = C21H44O4P2W (solution) + (g)
By formula: C21H44O3P2W (solution) + H2O (solution) = C21H44O4P2W (solution) + H2 (g)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -4.5 ± 0.2 | kcal/mol | EqS | Kubas, Burns, et al., 1992 | solvent: Tetrahydrofuran; Temperature range: 203-298 K; MS |
By formula: C4HCoO4 (g) = 0.5H2 (g) + 4CO (g) + Co (cr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 30.38 ± 0.50 | kcal/mol | EqG | Bronshstein, Gankin, et al., 1966 | Please also see Pedley and Rylance, 1977 and Cox and Pilcher, 1970, 2. Temperature range: ca. 423-533 K; MS |
By formula: C4H8O + H2 = C4H10O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -26.50 ± 0.14 | kcal/mol | Chyd | Allinger, Glaser, et al., 1981 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -26.48 ± 0.06 | kcal/mol | Chyd | Dolliver, Gresham, et al., 1938 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -26.7 ± 0.6 kcal/mol; At 355°K; ALS |
C39H66N2O3P2W (solution) + (g) = C39H68O3P2W (solution) + (g)
By formula: C39H66N2O3P2W (solution) + H2 (g) = C39H68O3P2W (solution) + N2 (g)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.40 ± 0.41 | kcal/mol | EqS | Gonzalez and Hoff, 1989 | solvent: Tetrahydrofuran; Temperature range: 288-308 K; MS |
By formula: C4H4O4 + H2 = C4H6O4
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -36.3 ± 0.2 | kcal/mol | Chyd | Skinner and Snelson, 1959 | liquid phase; solvent: Ethanol; ALS |
ΔrH° | -36.61 ± 0.40 | kcal/mol | Chyd | Flitcroft, Skinner, et al., 1957 | liquid phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -36.4 ± 0.4 kcal/mol; ALS |
By formula: 2H2 + C14H10 = C14H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -59.64 ± 0.56 | kcal/mol | Chyd | Davis, Allinger, et al., 1985 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -64.2 ± 1.1 | kcal/mol | Chyd | Flitcroft and Skinner, 1958 | solid phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -64.1 ± 1.1 kcal/mol; ALS |
C39H66MoO3P3 (solution) + (g) = C39H68MoO3P2 (solution)
By formula: C39H66MoO3P3 (solution) + H2 (g) = C39H68MoO3P2 (solution)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -6.5 ± 0.2 | kcal/mol | EqS | Gonzalez and Hoff, 1989 | solvent: Tetrahydrofuran; Temperature range: 283-315 K; MS |
C16H34OP2Ru (solution) + (solution) = C16H34P2Ru (solution) + (solution)
By formula: C16H34OP2Ru (solution) + H2 (solution) = C16H34P2Ru (solution) + H2O (solution)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -5.90 ± 0.79 | kcal/mol | EqS | Bryndza, Fong, et al., 1987 | solvent: Tetrahydrofuran; The reaction enthalpy was identified with the reaction Gibbs energy, since the the entropy is expected to be small Bryndza, Fong, et al., 1987; MS |
By formula: C6H10O + H2 = C6H12O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -18.13 ± 0.12 | kcal/mol | Cm | Wiberg, Crocker, et al., 1991 | liquid phase; ALS |
ΔrH° | -15.18 ± 0.15 | kcal/mol | Chyd | Conn, Kistiakowsky, et al., 1939 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -15.42 ± 0.08 kcal/mol; At 355 K; ALS |
By formula: H2 + C5H10 = C5H12
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -30.341 | kcal/mol | Chyd | Dolliver, Gresham, et al., 1937 | gas phase; At 355 °K; ALS |
ΔrH° | -28.25 ± 0.10 | kcal/mol | Chyd | Kistiakowsky, Ruhoff, et al., 1936 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -28.49 ± 0.36 kcal/mol; At 355 K; ALS |
By formula: C5H8O + H2 = C5H10O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -14.40 ± 0.16 | kcal/mol | Cm | Wiberg, Crocker, et al., 1991 | liquid phase; ALS |
ΔrH° | -12.25 ± 0.15 | kcal/mol | Chyd | Conn, Kistiakowsky, et al., 1939 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -12.50 ± 0.06 kcal/mol; At 355 K; ALS |
By formula: H2 + C6H12 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -30.07 ± 0.13 | kcal/mol | Chyd | Rogers, Crooks, et al., 1987 | liquid phase; ALS |
ΔrH° | -30.10 ± 0.15 | kcal/mol | Chyd | Dolliver, Gresham, et al., 1937 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -30.34 ± 0.15 kcal/mol; AT 355 °K; ALS |
By formula: H2 + C6H12 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -25.98 ± 0.11 | kcal/mol | Chyd | Rogers, Crooks, et al., 1987 | liquid phase; ALS |
ΔrH° | -26.39 ± 0.10 | kcal/mol | Chyd | Kistiakowsky, Ruhoff, et al., 1936 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -26.63 ± 0.10 kcal/mol; At 355 K; ALS |
By formula: (Fe+ • H2) + H2 = (Fe+ • 2H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 17.0 ± 0.2 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 15.7 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 25.2 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 15.7 kcal/mol; M |
By formula: (Fe+ • 2H2) + H2 = (Fe+ • 3H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.4 ± 0.1 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 7.5 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 19.1 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 7.5 kcal/mol; M |
By formula: (Fe+ • 3H2) + H2 = (Fe+ • 4H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.7 ± 0.1 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 8.6 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 24.9 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 8.6 kcal/mol; M |
By formula: (Fe+ • 4H2) + H2 = (Fe+ • 5H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.6 ± 0.1 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 2.2 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 17.9 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 2.2 kcal/mol; M |
By formula: (Fe+ • 5H2) + H2 = (Fe+ • 6H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.7 ± 0.1 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 2.3 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 18.1 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 2.3 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -23.63 ± 0.33 | kcal/mol | Chyd | Hill, Morton, et al., 1980 | liquid phase; ALS |
ΔrH° | -23. | kcal/mol | Eqk | Frye and Weitkamp, 1969 | gas phase; ALS |
ΔrH° | -21.63 ± 0.14 | kcal/mol | Eqk | Naidus and Mueller, 1950 | gas phase; At 375-525 K; ALS |
By formula: C18H34O2 + H2 = C18H36O2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -29.54 ± 0.38 | kcal/mol | Chyd | Rogers, Hoyte, et al., 1978 | liquid phase; solvent: Hexane; Authors gave two values; ALS |
ΔrH° | -29.9 ± 0.2 | kcal/mol | Chyd | Rogers, Hoyte, et al., 1978 | liquid phase; solvent: Hexane; Authors gave two values; ALS |
By formula: H2 + C4H8O = C4H10O
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -12.95 | kcal/mol | Eqk | Buckley and Herington, 1965 | gas phase; ALS |
ΔrH° | -13.0 ± 0.1 | kcal/mol | Chyd | Dolliver, Gresham, et al., 1938 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -13.2 ± 0.1 kcal/mol; At 355 °K; ALS |
By formula: (Na+ • H2) + H2 = (Na+ • 2H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.41 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 2.25 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 12.4 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 2.25 kcal/mol; M |
By formula: (K+ • H2) + H2 = (K+ • 2H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.47 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 1.35 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 11.2 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 1.35 kcal/mol; M |
By formula: 2H2 + C10H8 = C10H12
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -29.8 | kcal/mol | Eqk | Frye and Weitkamp, 1969 | gas phase; ALS |
ΔrH° | -28.8 ± 1.2 | kcal/mol | Eqk | Wilson, Caflisch, et al., 1958 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -32.0 ± 1.2 kcal/mol; At 400 K; ALS |
By formula: Fe+ + H2 = (Fe+ • H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.5 ± 0.2 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 10.8 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 21.5 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1995 | gas phase; ΔrH(0K) = 10.8 kcal/mol; M |
C5H2CrO5 (g) = (g) + C5CrO5 (g)
By formula: C5H2CrO5 (g) = H2 (g) + C5CrO5 (g)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 15.0 ± 1.3 | kcal/mol | KinG | Wells, House, et al., 1994 | The reaction enthalpy relies on the measured activation energy and on the assumption of a negligible barrier for product recombination Wells, House, et al., 1994.; MS |
By formula: (Co+ • H2O) + H2 = (Co+ • H2 • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrS° | 24.7 | cal/mol*K | SIDT | Kemper, Bushnell, et al., 1993 | gas phase; ΔrS(530 K); M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19.8 (+0.6,-0.) | SIDT | Kemper, Bushnell, et al., 1993 | gas phase; ΔrS(530 K); M |
By formula: H2 + C3H7F = C3H8 + HF
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -20.20 ± 0.30 | kcal/mol | Chyd | Lacher, Kianpour, et al., 1956 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -21.11 ± 0.69 kcal/mol; %hf298_gas[kcal/mol]=-66.97±0.71; Kolesov and Kozina, 1986; ALS |
By formula: Na+ + H2 = (Na+ • H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.93 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 2.45 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 13.2 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 2.45 kcal/mol; M |
By formula: K+ + H2 = (K+ • H2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.86 | kcal/mol | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 1.45 kcal/mol; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 13.5 | cal/mol*K | SIDT | Bushnell, Kemper, et al., 1994 | gas phase; ΔrH(0K) = 1.45 kcal/mol; M |
By formula: H2 + C3H7F = C3H8 + HF
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -22.00 ± 0.50 | kcal/mol | Chyd | Lacher, Kianpour, et al., 1956 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -22.9 ± 1.6 kcal/mol; %hf298_gas[kcal/mol]=-66.71±0.62; Kolesov and Kozina, 1986; ALS |
By formula: H2 + C8H12O4 = C8H14O4
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -28.94 ± 0.05 | kcal/mol | Chyd | Turner, Meador, et al., 1957 | liquid phase; solvent: Acetic acid; ALS |
ΔrH° | -29.30 ± 0.15 | kcal/mol | Chyd | Williams, 1942 | liquid phase; solvent: Acetic acid; At 302 K; ALS |
By formula: 3H2 + C6H8 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -81.0 ± 0.6 | kcal/mol | Chyd | Fang and Rogers, 1992 | liquid phase; solvent: Cyclohexane; ALS |
ΔrH° | -80.50 ± 0.33 | kcal/mol | Chyd | Turner, Mallon, et al., 1973 | liquid phase; solvent: Glacial acetic acid; ALS |
By formula: 3H2 + C6H8 = C6H14
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -80.0 ± 0.6 | kcal/mol | Chyd | Fang and Rogers, 1992 | liquid phase; solvent: Cyclohexane; ALS |
ΔrH° | -79.43 ± 0.22 | kcal/mol | Chyd | Turner, Mallon, et al., 1973 | liquid phase; solvent: Glacial acetic acid; ALS |
By formula: H2 + C8H14 = C8H16
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -26.27 ± 0.14 | kcal/mol | Chyd | Turner and Garner, 1958 | liquid phase; solvent: Acetic acid; ALS |
ΔrH° | -26.27 ± 0.14 | kcal/mol | Chyd | Turner and Garner, 1957 | liquid phase; solvent: Acetic acid; ALS |
By formula: H2 + C8H14 = C8H16
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -25.08 ± 0.13 | kcal/mol | Chyd | Turner and Garner, 1958 | liquid phase; solvent: Acetic acid; ALS |
ΔrH° | -25.08 ± 0.13 | kcal/mol | Chyd | Turner and Garner, 1957 | liquid phase; solvent: Acetic acid; ALS |
By formula: 3H2 + C8H10 = C8H16
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -76.39 ± 0.44 | kcal/mol | Chyd | Turner, Mallon, et al., 1973 | liquid phase; solvent: Acetic acid; ALS |
ΔrH° | -72.36 ± 0.26 | kcal/mol | Chyd | Turner, Meador, et al., 1957, 2 | liquid phase; solvent: Acetic acid; ALS |
By formula: H2 + C10H20 = C10H22
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -29.69 ± 0.29 | kcal/mol | Chyd | Rogers and Skanupong, 1974 | liquid phase; solvent: Hexane; ALS |
ΔrH° | -29.89 ± 0.31 | kcal/mol | Chyd | Bretschneider and Rogers, 1970 | liquid phase; solvent: galcial acetic acid; ALS |
By formula: H2 + C7H10 = C7H12
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -31.1 ± 0.2 | kcal/mol | Chyd | Flury, Grob, et al., 1988 | liquid phase; solvent: Isooctane; ALS |
ΔrH° | -32.58 ± 0.52 | kcal/mol | Chyd | Rogers, Choi, et al., 1980 | liquid phase; solvent: Hexane; Author was aware that data differs from previously reported values; ALS |
References
Go To: Top, Reaction thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Davis, Allinger, et al., 1985
Davis, H.E.; Allinger, N.L.; Rogers, D.W.,
Enthalpies of hydrogenation of phenylalkynes: indirect determination of the enthalpy of formation of diphenylcyclopropenone,
J. Org. Chem., 1985, 50, 3601-3604. [all data]
Rogers and McLafferty, 1971
Rogers, D.W.; McLafferty, F.J.,
A new hydrogen calorimeter. Heats of hydrogenation of allyl and vinyl unsaturation adjacent to a ring,
Tetrahedron, 1971, 27, 3765-3775. [all data]
Flitcroft and Skinner, 1958
Flitcroft, T.L.; Skinner, H.A.,
Heats of hydrogenation Part 2.-Acetylene derivatives,
Trans. Faraday Soc., 1958, 54, 47-53. [all data]
Rogers, Crooks, et al., 1987
Rogers, D.W.; Crooks, E.; Dejroongruang, K.,
Enthalpies of hydrogenation of the hexenes,
J. Chem. Thermodyn., 1987, 19, 1209-1215. [all data]
Rogers and Crooks, 1983
Rogers, D.W.; Crooks, E.L.,
Enthalpies of hydrogenation of the isomers of n-hexene,
J. Chem. Thermodyn., 1983, 15, 1087-1092. [all data]
Rogers, Papadimetriou, et al., 1975
Rogers, D.W.; Papadimetriou, P.M.; Siddiqui, N.A.,
An improved hydrogen microcalorimeter for use with large molecules,
Mikrochim. Acta, 1975, 2, 389-400. [all data]
Rogers and Siddiqui, 1975
Rogers, D.W.; Siddiqui, N.A.,
Heats of hydrogenation of large molecules. I. Esters of unsaturated fatty acids,
J. Phys. Chem., 1975, 79, 574-577. [all data]
Doering, Roth, et al., 1988
Doering, W.E.; Roth, W.R.; Breuckmann, R.; Figge, L.; Lennartz, H.-W.; Fessner, W.-D.; Prinzbach, F.H.,
Verbotene Reaktionen. - [2 + 2]-Cycloreversion starrer Cyclobutane,
Chem. Ber., 1988, 121, 1-9. [all data]
Rogers, Choi, et al., 1980
Rogers, D.W.; Choi, L.S.; Girellini, R.S.,
Heats of hydrogenation and formation of quadricyclene, norbornadiene, norbornene, and nortricyclene,
J. Phys. Chem., 1980, 84, 1810-1814. [all data]
Turner, Meador, et al., 1957
Turner, R.B.; Meador, W.R.; Winkler, R.E.,
Heats of hydrogenation. I. Apparatus and the heats of hydrogenation of bicyclo[2,2,1]heptene, bicyclo[2,2,1]heptadiene, bicyclo[2,2,2]octene and bicyclo[2,2,2]octadiene,
J. Am. Chem. Soc., 1957, 79, 4116-4121. [all data]
Molnar, Rachford, et al., 1984
Molnar, A.; Rachford, R.; Smith, G.V.; Liu, R.,
Heats of hydrogenation by a simple and rapid flow calorimetric method,
Appl. Catal., 1984, 9, 219-223. [all data]
Rogers and Dejroongruang, 1989
Rogers, D.W.; Dejroongruang, K.,
Enthalpies of hydrogenation of the dimethylpentenes, ethylpentenes, methylbutene, and trimethylbutene,
J. Chem. Thermodyn., 1989, 21, 1115-1120. [all data]
Dolliver, Gresham, et al., 1937
Dolliver, M.a.; Gresham, T.L.; Kistiakowsky, G.B.; Vaughan, W.E.,
Heats of organic reactions. V. Heats of hydrogenation of various hydrocarbons,
J. Am. Chem. Soc., 1937, 59, 831-841. [all data]
Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G.,
Thermochemistry of Organic and Organometallic Compounds, Academic Press, New York, 1970, 1-636. [all data]
Lopes, Nunes, et al., 1975
Lopes, M.T.R.; Nunes, M.F.T.; Florencio, M.H.F.S.; Mota, M.M.G.; Fernandez, M.T.N.,
Heats of hydrogenation in solution. I. Calorimeter for semimicro determinations,
Rev. Port. Quim., 1975, 15, 129-132. [all data]
Wiberg, Crocker, et al., 1991
Wiberg, K.B.; Crocker, L.S.; Morgan, K.M.,
Thermochemical studies of carbonyl compounds. 5. Enthalpies of reduction of carbonyl groups,
J. Am. Chem. Soc., 1991, 113, 3447-3450. [all data]
Dolliver, Gresham, et al., 1938
Dolliver, M.A.; Gresham, T.L.; Kistiakowsky, G.B.; Smith, E.A.; Vaughan, W.E.,
Heats of organic reactions. VI. Heats of hydrogenation of some oxygen-containing compounds,
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Kubas, Burns, et al., 1992
Kubas, G.J.; Burns, C.J.; Khalsa, G.R.K.; van der Sluys, L.S.; Kiss, G.; Hoff, C.D.,
Organometallics, 1992, 11, 3390. [all data]
Bronshstein, Gankin, et al., 1966
Bronshstein, Yu.E.; Gankin, V.Yu.; Krinkin, D.P.; Rudkovskii, D.M.,
Russ. J. Phys. Chem., 1966, 40, 802. [all data]
Pedley and Rylance, 1977
Pedley, J.B.; Rylance, J.,
Computer Analysed Thermochemical Data: Organic and Organometallic Compounds, University of Sussex, Brigton, 1977. [all data]
Cox and Pilcher, 1970, 2
Cox, J.D.; Pilcher, G.,
Thermochemistry of Organic and Organometallic Compounds
in Academic Press, New York, 1970. [all data]
Allinger, Glaser, et al., 1981
Allinger, N.L.; Glaser, J.A.; Davis, H.E.,
Heats of hydrogenation of some vinyl ethers and related compounds,
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Gonzalez and Hoff, 1989
Gonzalez, A.A.; Hoff, C.D.,
Inorg. Chem., 1989, 28, 4295. [all data]
Skinner and Snelson, 1959
Skinner, H.A.; Snelson, A.,
Heats of hydrogenation Part 3.,
Trans. Faraday Soc., 1959, 55, 405-407. [all data]
Flitcroft, Skinner, et al., 1957
Flitcroft, T.; Skinner, H.A.; Whiting, M.C.,
Heats of hydrogenation Part 1.-Dodeca-3:9 and -5:7 Diynes,
Trans. Faraday Soc., 1957, 53, 784-790. [all data]
Bryndza, Fong, et al., 1987
Bryndza, H.E.; Fong, L.K.; Paciello, R.A.; Tam, W.; Bercaw, J.E.,
J. Am. Chem. Soc., 1987, 109, 1444. [all data]
Conn, Kistiakowsky, et al., 1939
Conn, J.B.; Kistiakowsky, G.B.; Smith, E.A.,
Heats of organic reactions. VIII. Some further hydrogenations, including those of some acetylenes,
J. Am. Chem. Soc., 1939, 61, 1868-1876. [all data]
Kistiakowsky, Ruhoff, et al., 1936
Kistiakowsky, G.B.; Ruhoff, J.R.; Smith, H.A.; Vaughan, W.E.,
Heats of organic reactions. III. Hydrogenation of some higher olefins,
J. Am. Chem. Soc., 1936, 58, 137-145. [all data]
Bushnell, Kemper, et al., 1995
Bushnell, J.E.; Kemper, P.R.; Bowers, M.T.,
Factors Affecting sigma Bond Activation in Simple Systems; Measurement of Experimental Binding energies of Fe+(H2)1-6 Clusters,
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Hill, Morton, et al., 1980
Hill, R.K.; Morton, G.H.; Rogers, D.W.; Choi, L.S.,
Rearrangement of 1,1'-spirobiindene and thermochemical evidence for its spiroconjugative destabilization,
J. Org. Chem., 1980, 45, 5163-5166. [all data]
Frye and Weitkamp, 1969
Frye, C.G.; Weitkamp, A.W.,
Equilibrium hydrogenations of multi-ring aromatics,
J. Chem. Eng. Data, 1969, 14, 372-376. [all data]
Naidus and Mueller, 1950
Naidus, E.S.; Mueller, M.B.,
Equilibrium studies on the hydrindene-indene-hydrogen system,
J. Am. Chem. Soc., 1950, 72, 1829-1831. [all data]
Rogers, Hoyte, et al., 1978
Rogers, D.W.; Hoyte, O.P.A.; Ho, R.K.C.,
Heats of hydrogenation of large molecules. Part 2. Six unsaturated and polyunsaturated fatty acids,
J. Chem. Soc. Faraday Trans. 1, 1978, 74, 46-52. [all data]
Buckley and Herington, 1965
Buckley, E.; Herington, E.F.G.,
Equilibria in some secondary alcohol + hydrogen + ketone systems,
Trans. Faraday Soc., 1965, 61, 1618-1625. [all data]
Bushnell, Kemper, et al., 1994
Bushnell, J.E.; Kemper, P.R.; Bowers, M.T.,
Na+/K+(H2)1,2 clusters: experiment,
J. Phys. Chem., 1994, 98, 8, 2044, https://doi.org/10.1021/j100059a011
. [all data]
Wilson, Caflisch, et al., 1958
Wilson, T.P.; Caflisch, E.G.; Hurley, G.F.,
The naphthalene-tetralin-hydrogen equilibrium at elevated temperature and pressure,
J. Phys. Chem., 1958, 62, 1059. [all data]
Wells, House, et al., 1994
Wells, J.R.; House, P.G.; Weitz, E.,
J. Phys. Chem., 1994, 98, 8343. [all data]
Kemper, Bushnell, et al., 1993
Kemper, P.R.; Bushnell, J.; Von Koppen, P.; Bowers, M.T.,
Binding Energies of Co+(H2/CH4/C2H6)1,2,3 Clusters,
J. Phys. Chem., 1993, 97, 9, 1810, https://doi.org/10.1021/j100111a016
. [all data]
Lacher, Kianpour, et al., 1956
Lacher, J.R.; Kianpour, A.; Park, J.D.,
Reaction heats of organic halogen compounds. VI. The catalytic hydrogenation of some alkyl fluorides,
J. Phys. Chem., 1956, 60, 1454-1455. [all data]
Kolesov and Kozina, 1986
Kolesov, V.P.; Kozina, M.P.,
Thermochemistry of organic and organohalogen compounds,
Russ. Chem. Rev., 1986, 55, 912. [all data]
Williams, 1942
Williams, R.B.,
Heats of catalytic hydrogenation in solution. I. Apparatus, technique, and the heats of hydrogenation of certain pairs of stereoisomers,
J. Am. Chem. Soc., 1942, 64, 1395-1404. [all data]
Fang and Rogers, 1992
Fang, W.; Rogers, D.W.,
Enthalpy of hydrogenation of the hexadienes and cis- and trans-1,3,5-hexatriene,
J. Org. Chem., 1992, 57, 2294-2297. [all data]
Turner, Mallon, et al., 1973
Turner, R.B.; Mallon, B.J.; Tichy, M.; Doering, W.v.E.; Roth, W.R.; Schroder, G.,
Heats of hydrogenation. X. Conjugative interaction in cyclic dienes and trienes,
J. Am. Chem. Soc., 1973, 95, 8605-8610. [all data]
Turner and Garner, 1958
Turner, R.B.; Garner, R.H.,
Heats of hydrogenation. V. Relative stabilities in certain exocyclic-endocyclic olefin pairs,
J. Am. Chem. Soc., 1958, 80, 1424-1430. [all data]
Turner and Garner, 1957
Turner, R.B.; Garner, R.H.,
Heats of hydrogenation. V. Relative stabilities in certain exocyclic-endocyclic olefin pairs,
J. Am. Chem. Soc., 1957, 80, 1424-1430. [all data]
Turner, Meador, et al., 1957, 2
Turner, R.B.; Meador, W.R.; Doering, W.E.; Knox, L.H.; Mayer, J.R.; Wiley, D.W.,
Heats of hydrogenation. III. Hydrogenation of cycllooctatetraene and of some seven-membered non-benzenoid aromatic compounds,
J. Am. Chem. Soc., 1957, 79, 4127-4133. [all data]
Rogers and Skanupong, 1974
Rogers, D.W.; Skanupong, S.,
Heats of hydrogenation of sixteen terminal monoolefins. The alternating effect,
J. Phys. Chem., 1974, 78, 2569-2572. [all data]
Bretschneider and Rogers, 1970
Bretschneider, E.; Rogers, D.W.,
A new microcalorimeter: heats of hydrogenation of four monoolefins,
Mikrochim. Acta, 1970, 482-490. [all data]
Flury, Grob, et al., 1988
Flury, P.; Grob, C.A.; Wang, G.Y.; Lennatz, H.-W.; Roth, W.R.,
113. Norbornanes. Bridging strain in norbornyl and oxanorbornyl cations,
Helv. Chim. Acta, 1988, 71, 1017-1024. [all data]
Notes
Go To: Top, Reaction thermochemistry data, References
- Symbols used in this document:
T Temperature ΔrH° Enthalpy of reaction at standard conditions ΔrS° Entropy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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