1,1',1"-(5'-Phenyl[1,1':3',1"-terphenyl]-2',4',6'-triyl)trisethanone


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: Glushko Thermocenter, Russian Academy of Sciences, Moscow

Quantity Value Units Method Reference Comment
gas831.29J/mol*KN/ADos Santos H.F., 1995This value was calculated by quantum-mechanical semiempirical AM1 method for the most stable isomer. Estimation by group additivity approach is 912 J/mol*K [ Dorofeeva O.V., 1997].

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.

Dos Santos H.F., 1995
Dos Santos H.F., AM1 study of the conformational equilibrium and infrared spectrum for 1,2,4- and 1,3,5-substituted benzenes, Vib. Spectrosc., 1995, 10, 13-28. [all data]

Dorofeeva O.V., 1997
Dorofeeva O.V., Unpublished results. Thermocenter of Russian Academy of Science, Moscow, 1997. [all data]


Notes

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