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Benzotrifluoride: chemical thermodynamic properties and internal rotation

Journal Article · · J. Am. Chem. Soc.; (United States)
DOI:https://doi.org/10.1021/ja01514a001· OSTI ID:7305408
Thermodynamic and spectroscopic information was used to show that internal rotation in benzotrifluoride is nearly free. The chemical thermodynamic properties in the vapor state (0 to 1500/sup 0/K) were calculated by methods of statistical mechanics. Experimental studies provided the following information. Values of heat capacity for the solid (12/sup 0/K to the triple point), the liquid (triple point to 370/sup 0/K) and the vapor (363 to 500/sup 0/K); the triple point temperature; the heat of fusion; thermodynamic functions for the solid and liquid (0 to 370/sup 0/K); heat of vaporization (334 to 375/sup 0/K); second virial coefficient (334 to 500/sup 0/K); and vapor pressure (328 to 412/sup 0/K).
Research Organization:
Bureau of Mines, Bartlesville, OK
OSTI ID:
7305408
Journal Information:
J. Am. Chem. Soc.; (United States), Journal Name: J. Am. Chem. Soc.; (United States) Vol. 81:5; ISSN JACSA
Country of Publication:
United States
Language:
English