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3-Hexene, 2,2-dimethyl-, (Z)-

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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: Donald R. Burgess, Jr.

Quantity Value Units Method Reference Comment
Deltafgas-23.1kcal/molN/AYates and McDonald, 1973Value computed using «DELTA»fHliquid° value of -136.4±1.5 kj/mol from Yates and McDonald, 1973 and «DELTA»vapH° value of 39.8 kj/mol from alkenes correlation.

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-32.60 ± 0.37kcal/molCcbYates and McDonald, 1973 
Quantity Value Units Method Reference Comment
Deltacliquid-1266.34 ± 0.37kcal/molCcbYates and McDonald, 1973Corresponding «DELTA»fliquid = -32.59 kcal/mol (simple calculation by NIST; no Washburn corrections)
Deltacliquid-1263.97 ± 0.17kcal/molCcbYates and McDonald, 1971Corresponding «DELTA»fliquid = -34.96 kcal/mol (simple calculation by NIST; no Washburn corrections)
Deltacliquid-1268.72 ± 0.59kcal/molCcbRockenfeller and Rossini, 1961Derived from the ratio of Heat of combustion; Corresponding «DELTA»fliquid = -30.21 kcal/mol (simple calculation by NIST; no Washburn corrections)

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.

Yates and McDonald, 1973
Yates, K.; McDonald, R.S., Kinetics and mechanisms of electrophilic addition. II. A thermochemical-kinetic approach to transition-state structure, J. Org. Chem., 1973, 38, 2465-2478. [all data]

Yates and McDonald, 1971
Yates, K.; McDonald, R.S., A thermochemical probe into the mechanism of electrophilic addition to olefins, J. Am. Chem. Soc., 1971, 93, 6297-6299. [all data]

Rockenfeller and Rossini, 1961
Rockenfeller, J.D.; Rossini, F.D., Heats of combustion, isomerization, and formation of selected C7, C8, and C10 monoolefin hydrocarbons, J. Phys. Chem., 1961, 65, 267-272. [all data]


Notes

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