1,3-Cyclohexadiene, 1-methyl-

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

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Individual Reactions

1,3-Cyclohexadiene, 5-methyl- = 1,3-Cyclohexadiene, 1-methyl-

By formula: C7H10 = C7H10

Quantity Value Units Method Reference Comment
Δr10. ± 3.kJ/molKinDoering, Roth, et al., 1991gas phase; At 603 K

1,3-Cyclohexadiene, 1-methyl- = 1,3-Cyclohexadiene, 3-methyl

By formula: C7H10 = C7H10

Quantity Value Units Method Reference Comment
Δr3. ± 4.6kJ/molKinDoering, Roth, et al., 1991gas phase; At 603 K

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: Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

View reactions leading to C7H10+ (ion structure unspecified)

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C6H7+10.67CH3EIGorfinkel', Isaev, et al., 1969 

References

Go To: Top, Reaction thermochemistry data, Gas phase ion energetics data, Notes

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

Doering, Roth, et al., 1991
Doering, W.E.; Roth, W.R.; Bauer, F.; Boenke, M.; Breuckmann, R.; Ruhkamp, J.; Wortmann, O., Rotationsbarrieren Vinyl-substituierter Olefine, Chem. Ber., 1991, 124, 1461-1470. [all data]

Gorfinkel', Isaev, et al., 1969
Gorfinkel', M.I.; Isaev, I.S.; Shleider, I.A.; Koptyug, V.A., Structure of C6H7+ ions in the mass spectra of cyclohexadienes and their monomethyl derivatives. III. C6H7+ ions from 1-methyl-13C 1,3- and -1,4-cyclohexadienes and 5-methyl-1,3-cyclohexadiene, Zh. Obahch. Khim., 1969, 39, 1363. [all data]


Notes

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