Ethane

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Gas phase 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:
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
GT - Glushko Thermocenter, Russian Academy of Sciences, Moscow

Quantity Value Units Method Reference Comment
Δfgas-84. ± 0.4kJ/molReviewManion, 2002adopted recommendation of Gurvich, Veyts, et al., 1991; DRB
Δfgas-83.8 ± 0.3kJ/molCcbPittam and Pilcher, 1972ALS
Δfgas-84.67 ± 0.49kJ/molCcbProsen and Rossini, 1945Hf derived from Heat of Hydrogenation; ALS
Quantity Value Units Method Reference Comment
Δcgas-1560.7 ± 0.3kJ/molCcbPittam and Pilcher, 1972Corresponding Δfgas = -83.85 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
Δcgas-1559.9 ± 0.46kJ/molCcbProsen and Rossini, 1945Hf derived from Heat of Hydrogenation; Corresponding Δfgas = -84.64 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
Δcgas-1559.8 ± 0.46kJ/molCcbRossini, 1934Corresponding Δfgas = -84.68 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS

Constant pressure heat capacity of gas

Cp,gas (J/mol*K) Temperature (K) Reference Comment
35.70100.Gurvich, Veyts, et al., 1989p=1 bar. Recommended entropies and heat capacities are in good agreement with those obtained from other statistical thermodynamic calculations [ Pitzer K.S., 1944, Chao J., 1973, Pamidimukkala K.M., 1982].; GT
42.30200.
52.49298.15
52.71300.
65.46400.
77.94500.
89.19600.
99.14700.
107.94800.
115.71900.
122.551000.
128.551100.
133.801200.
138.391300.
142.401400.
145.901500.
148.981600.
151.671700.
154.041800.
156.141900.
158.002000.
159.652100.
161.122200.
162.432300.
163.612400.
164.672500.
165.632600.
166.492700.
167.282800.
168.002900.
168.653000.

Constant pressure heat capacity of gas

Cp,gas (J/mol*K) Temperature (K) Reference Comment
41.66 ± 0.31189.20Halford J.O., 1957Please also see Eucken A., 1933, Kistiakowsky G.B., 1939, Dailey B.P., 1943.; GT
43.25 ± 0.32209.30
45.08 ± 0.34229.65
47.27 ± 0.35249.90
47.17 ± 0.35250.15
49.68 ± 0.37272.00
49.51 ± 0.04272.07
50.66 ± 0.42279.00
52.14 ± 0.39292.00
53.27 ± 0.07302.70
57.40 ± 0.04335.82
58.91347.65
60.38359.75
61.04 ± 0.10364.78
62.10 ± 0.47373.60
63.89387.55
72.43451.95
80.08520.55
86.27561.65
90.46603.25

Ion clustering 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:
RCD - Robert C. Dunbar
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. Searches may be limited to ion clustering reactions. A general reaction search form is also available.

Clustering reactions

Aluminum ion (1+) + Ethane = (Aluminum ion (1+) • Ethane)

By formula: Al+ + C2H6 = (Al+ • C2H6)

Quantity Value Units Method Reference Comment
Δr38. ± 8.4kJ/molCIDC,EqGStockigt, Schwarz, et al., 1996Anchored to theory; RCD

C2H4+ + Ethane = (C2H4+ • Ethane)

By formula: C2H4+ + C2H6 = (C2H4+ • C2H6)

Quantity Value Units Method Reference Comment
Δr64.0kJ/molPHPMSHiraoka and Kebarle, 1980gas phase; M
Quantity Value Units Method Reference Comment
Δr88.J/mol*KPHPMSHiraoka and Kebarle, 1980gas phase; M

(Cobalt ion (1+) • Methane) + Ethane = (Cobalt ion (1+) • Ethane • Methane)

By formula: (Co+ • CH4) + C2H6 = (Co+ • C2H6 • CH4)

Quantity Value Units Method Reference Comment
Δr108.J/mol*KSIDTKemper, Bushnell, et al., 1993gas phase; switching reaction(Co+).2CH4, ΔrS(480 K); M

Enthalpy of reaction

ΔrH° (kJ/mol) T (K) Method Reference Comment
119. (+5.4,-0.) SIDTKemper, Bushnell, et al., 1993gas phase; switching reaction(Co+).2CH4, ΔrS(480 K); M

Cobalt ion (1+) + Ethane = (Cobalt ion (1+) • Ethane)

By formula: Co+ + C2H6 = (Co+ • C2H6)

Quantity Value Units Method Reference Comment
Δr93.3J/mol*KSIDTKemper, Bushnell, et al., 1993gas phase; switching reaction(Co+)CH4, ΔrS(500 K); M

Enthalpy of reaction

ΔrH° (kJ/mol) T (K) Method Reference Comment
100. (+5.0,-0.) CIDArmentrout and Kickel, 1994gas phase; guided ion beam CID; M
117. (+6.7,-0.) SIDTKemper, Bushnell, et al., 1993gas phase; switching reaction(Co+)CH4, ΔrS(500 K); M

(Cobalt ion (1+) • 2Ethane) + Ethane = (Cobalt ion (1+) • 3Ethane)

By formula: (Co+ • 2C2H6) + C2H6 = (Co+ • 3C2H6)

Quantity Value Units Method Reference Comment
Δr50.kJ/molSIDTKemper, Bushnell, et al., 1993gas phase; ΔrH<; M

Iron ion (1+) + Ethane = (Iron ion (1+) • Ethane)

By formula: Fe+ + C2H6 = (Fe+ • C2H6)

Quantity Value Units Method Reference Comment
Δr70. ± 10.kJ/molMKERCarpenter, van Koppen, et al., 1995gas phase; M

Enthalpy of reaction

ΔrH° (kJ/mol) T (K) Method Reference Comment
64.0 (+5.9,-0.) CIDArmentrout and Kickel, 1994gas phase; guided ion beam CID; M

Nickel ion (1+) + Ethane = (Nickel ion (1+) • Ethane)

By formula: Ni+ + C2H6 = (Ni+ • C2H6)

Quantity Value Units Method Reference Comment
Δr120. ± 10.kJ/molMKERCarpenter, van Koppen, et al., 1995gas phase; M

References

Go To: Top, Gas phase thermochemistry data, Ion clustering data, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Manion, 2002
Manion, J.A., Evaluated Enthalpies of Formation of the Stable Closed Shell C1 and C2 Chlorinated Hydrocarbons, J. Phys. Chem. Ref. Data, 2002, 31, 1, 123-172, https://doi.org/10.1063/1.1420703 . [all data]

Gurvich, Veyts, et al., 1991
Thermodynamic Properties of Individual Substances, 4th edition, Volume 2, Gurvich, L.V.; Veyts, I.V.; Alcock, C.B.;, ed(s)., Hemisphere, New York, 1991. [all data]

Pittam and Pilcher, 1972
Pittam, D.A.; Pilcher, G., Measurements of heats of combustion by flame calorimetry. Part 8.-Methane, ethane, propane, n-butane and 2-methylpropane, J. Chem. Soc. Faraday Trans. 1, 1972, 68, 2224-2229. [all data]

Prosen and Rossini, 1945
Prosen, E.J.; Rossini, F.D., Heats of combustion and formation of the paraffin hydrocarbons at 25° C, J. Res. NBS, 1945, 263-267. [all data]

Rossini, 1934
Rossini, F.D., Calorimetric determination of the heats of combustion of ethane, propane, normal butane, and normal pentane, J. Res. NBS, 1934, 12, 735-750. [all data]

Gurvich, Veyts, et al., 1989
Gurvich, L.V.; Veyts, I.V.; Alcock, C.B., Thermodynamic Properties of Individual Substances, 4th ed.; Vols. 1 and 2, Hemisphere, New York, 1989. [all data]

Pitzer K.S., 1944
Pitzer K.S., Thermodynamics of gaseous paraffins. Specific heat and related properties, Ind. Eng. Chem., 1944, 36, 829-831. [all data]

Chao J., 1973
Chao J., Ideal gas thermodynamic properties of ethane and propane, J. Phys. Chem. Ref. Data, 1973, 2, 427-438. [all data]

Pamidimukkala K.M., 1982
Pamidimukkala K.M., Ideal gas thermodynamic properties of CH3, CD3, CD4, C2D2, C2D4, C2D6, C2H6, CH3N2CH3, and CD3N2CD3, J. Phys. Chem. Ref. Data, 1982, 11, 83-99. [all data]

Halford J.O., 1957
Halford J.O., Standard heat capacities of gaseous methanol, ethanol, methane and ethane at 279 K by thermal conductivity, J. Phys. Chem., 1957, 61, 1536-1539. [all data]

Eucken A., 1933
Eucken A., Molar heats and normal frequencies of ethane and ethylene, Z. Phys. Chem., 1933, B20, 184-194. [all data]

Kistiakowsky G.B., 1939
Kistiakowsky G.B., Gaseous heat capacities. I. The method and the heat capacities of C2H6 and C2D6, J. Chem. Phys., 1939, 7, 281-288. [all data]

Dailey B.P., 1943
Dailey B.P., The heat capacities at higher temperatures of ethane and propane, J. Am. Chem. Soc., 1943, 65, 42-44. [all data]

Stockigt, Schwarz, et al., 1996
Stockigt, D.; Schwarz, J.; Schwarz, H., Theoretical and Experimental Studies on the Bond Dissociation Energies of Al(methane)+, Al(acetylene)+, Al(ethene)+, and Al(ethane)+, J. Phys. Chem., 1996, 100, 21, 8786, https://doi.org/10.1021/jp960060k . [all data]

Hiraoka and Kebarle, 1980
Hiraoka, K.; Kebarle, P., Ion Molecule Reactions in Ethane. Thermochemistry and Structures of the Intermediate Complexes: C4H11+ and C4H10+ Formed in the Reactions of C2H5+ and C2H4+ with C2H6, Can. J. Chem., 1980, 58, 21, 2262, https://doi.org/10.1139/v80-364 . [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]

Armentrout and Kickel, 1994
Armentrout, P.B.; Kickel, B.L., Gas Phase Thermochemistry of Transition Metal Ligand Systems: Reassessment of Values and Periodic Trends, in Organometallic Ion Chemistry, B. S. Freiser, ed, 1994. [all data]

Carpenter, van Koppen, et al., 1995
Carpenter, C.J.; van Koppen, P.A.M.; Bowers, M.T., Details of Potential Energy Surfaces Involving C-C Bond Activation: Reactions of Fe+, Co+ and Ni+ with Acetone, J. Am. Chem. Soc., 1995, 117, 44, 10976, https://doi.org/10.1021/ja00149a021 . [all data]


Notes

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