Cyclohexane, chloro-

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Condensed 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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfliquid-49.98 ± 0.46kcal/molCcbAn and Guo, 1995Author was aware that data differs from previously reported values; HCl(1:600 H2O)
Δfliquid-49.45 ± 0.50kcal/molCmDiky, Kabo, et al., 1994 
Δfliquid-49.5kcal/molCmKirkbride, 1956 
Quantity Value Units Method Reference Comment
Δcliquid-895.69 ± 0.45kcal/molCcbAn and Guo, 1995Author was aware that data differs from previously reported values; HCl(1:600 H2O)

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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

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.

Individual Reactions

Cyclohexane, chloro- + Hydrogen chloride = Cyclohexane + Chlorine

By formula: C6H11Cl + HCl = C6H12 + Cl2

Quantity Value Units Method Reference Comment
Δr-34.20kcal/molCmKirkbride, 1956liquid phase

Gas phase ion energetics 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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

IE (eV) Method Reference Comment
10.10 ± 0.01PISergeev, Akopyan, et al., 1973LLK
10.67PESergeev, Akopyan, et al., 1973Vertical value; LLK

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C4H6+11.07 ± 0.03?PISergeev, Akopyan, et al., 1973LLK
C4H7+11.52 ± 0.05?PISergeev, Akopyan, et al., 1973LLK
C4H8+10.2 ± 0.01?PISergeev, Akopyan, et al., 1973LLK
C4H9+10.56 ± 0.02?PISergeev, Akopyan, et al., 1973LLK
C5H7+10.67 ± 0.05?PISergeev, Akopyan, et al., 1973LLK
C5H9+11.01 ± 0.02?PISergeev, Akopyan, et al., 1973LLK
C6H9+10.40 ± 0.02?PISergeev, Akopyan, et al., 1973LLK
C6H10+10.10 ± 0.05?PISergeev, Akopyan, et al., 1973LLK
C6H11+10.20 ± 0.05?PISergeev, Akopyan, et al., 1973LLK

References

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

An and Guo, 1995
An, X.-W.; Guo, D.-J., Formation enthalpies and non-bonding interactions of hexachlorocyclohexanes, Thermochim. Acta, 1995, 253, 235-242. [all data]

Diky, Kabo, et al., 1994
Diky, V.V.; Kabo, G.J.; Kozyro, A.A.; Krasulin, A.P.; Sevruk, V.M., Thermodynamic properties of crystalline and liquid chlorocyclohexane and inversion of ring, J. Chem. Thermodyn., 1994, 26, 1001-1013. [all data]

Kirkbride, 1956
Kirkbride, F.W., The heats of chlorination of some hydrocarbons and their chloro-derivatives, J. Appl. Chem., 1956, 6, 11-21. [all data]

Sergeev, Akopyan, et al., 1973
Sergeev, Yu.L.; Akopyan, M.E.; Vilesov, F.I.; Chizhov, Yu.V., Photoionization processes in gaseous cyclohexane, and chloro- and bromocyclohexane, High Energy Chem., 1973, 7, 369, In original 418. [all data]


Notes

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