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Decafluorocyclohexene

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

Quantity Value Units Method Reference Comment
Deltafgas  CmAndreevskii and Antonova, 1982uncertain value: -454.9 kcal/mol
Deltafgas-461.9 ± 1.7kcal/molCcbPrice and Sapiano, 1979Reanalyzed by Pedley, Naylor, et al., 1986, Original value = -455.7 ± 1.7 kcal/mol; hf_CF4=-933.0 kJ/mol incomplete combustion
Deltafgas-462.59kcal/molCcrCox, Gundry, et al., 1964 

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
Deltafliquid-469.94kcal/molCcrCox, Gundry, et al., 1964 
Quantity Value Units Method Reference Comment
Deltacliquid-356.009kcal/molCcbPrice and Sapiano, 1979hf_CF4=-933.0 kJ/mol incomplete combustion
Deltacliquid-522.15 ± 0.51kcal/molCcrCox, Gundry, et al., 1964 

Phase change 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
AC - William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Deltavap7.400kcal/molVPrice and Sapiano, 1979hf_CF4=-933.0 kJ/mol incomplete combustion; ALS
Deltavap7.41kcal/molN/APrice and Sapiano, 1979Based on data from 277. - 319. K.; AC
Deltavap7.35kcal/molVCox, Gundry, et al., 1964ALS

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 by: John E. Bartmess

View reactions leading to C6F10+ (ion structure unspecified)

Electron affinity determinations

EA (eV) Method Reference Comment
>1.40 ± 0.30EndoLifshitz, Tiernan, et al., 1973 

IR Spectrum

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Data compiled by: Coblentz Society, Inc.


Gas Chromatography

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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: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

View large format table.

Column type Active phase Temperature (C) I Reference Comment
PackedSqualane50.316.Müller, Dietrich, et al., 1983 

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.

Andreevskii and Antonova, 1982
Andreevskii, D.N.; Antonova, Z.A., Development of an increment scheme for calculating the thermodynamic properties of organic polyfluoro compounds, J. Appl. Chem. USSR, 1982, 55, 582-587. [all data]

Price and Sapiano, 1979
Price, S.J.W.; Sapiano, H.J., Determination of «DELTA»H°f298(C6F10,g) and «DELTA»H°f298(C6F12,g) from studies of the combustion of decafluorocyclohexene and dodecafluorocylohexene in oxygen and calculation of the resonance energy of hexafluorobenzene, Can. J. Chem., 1979, 58, 685-688. [all data]

Pedley, Naylor, et al., 1986
Pedley, J.B.; Naylor, R.D.; Kirby, S.P., Thermochemical Data of Organic Compounds, Chapman and Hall, New York, 1986, 1-792. [all data]

Cox, Gundry, et al., 1964
Cox, J.D.; Gundry, H.A.; Head, A.J., Thermodynamic properties of fluorine compounds. Part 1.-Heats of combustion of p-fluorobenzoic acid, pentafluorobenzoic acid, hexafluorobenzene and decafluorocyclohexene, Trans. Faraday Soc., 1964, 60, 653-665. [all data]

Lifshitz, Tiernan, et al., 1973
Lifshitz, C.; Tiernan, T.O.; Hughes, B.M., Electron affinities from endothermic negative-ion charge transfer reactions. IV. SF6, selected fluorocarbons, and other polyatomic molecules, J. Chem. Phys., 1973, 59, 3182. [all data]

Müller, Dietrich, et al., 1983
Müller, U.; Dietrich, P.; Prescher, D., Gaschromatographische Untersuchungen an Perfluor-Carbonverbindungen. II. Zur Gaschromatographischen Trennung von Gemischen Längerkettiger Perfluoralkane und Perfluoralkene, J. Chromatogr., 1983, 259, 243-254, https://doi.org/10.1016/S0021-9673(01)88005-5 . [all data]


Notes

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