Bicyclo(3.1.0)hex-2-ene


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
Δfgas37.8kcal/molChydRoth, Adamczak, et al., 1991 

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
Δfliquid28.8 ± 0.7kcal/molCcbKozina, 1976 
Quantity Value Units Method Reference Comment
Δcliquid-866.4 ± 0.7kcal/molCcbKozina, 1976Corresponding Δfliquid = 28.8 kcal/mol (simple calculation by NIST; no Washburn corrections)

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

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Individual Reactions

2Hydrogen + Bicyclo(3.1.0)hex-2-ene = Cyclopentane, methyl-

By formula: 2H2 + C6H8 = C6H12

Quantity Value Units Method Reference Comment
Δr-63.1 ± 0.2kcal/molChydRoth, Adamczak, et al., 1991liquid phase

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.

Roth, Adamczak, et al., 1991
Roth, W.R.; Adamczak, O.; Breuckmann, R.; Lennartz, H.-W.; Boese, R., Die Berechnung von Resonanzenergien; das MM2ERW-Kraftfeld, Chem. Ber., 1991, 124, 2499-2521. [all data]

Kozina, 1976
Kozina, M.P., Enthalpies of combustion and formation of bicyclic and polycyclic hydrocarbons, Sovrem. Probl. Fiz. Khim., 1976, 9, 198-225. [all data]


Notes

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