Experimental and theoretical studies of the vibrations and structure of 2,2,2-trifluoroethyl trifluoroacetate, CF3CO2CH2CF3

Journal of Molecular Structure

Volumn 917, Issue 2-3, 2009, Pages 183-192

  Defonsi Lestard, María Eliana ^a   Tuttolomondo, María Eugenia ^a   Varetti, Eduardo Lelio ^b   Wann, Derek A ^c   Robertson, Heather E ^c   Rankin, David W H ^c   Ben Altabef, Aida ^a  

^a UNIVERSIDAD NACIONAL DE TUCUMÁN   (Argentina)

^b FACULTAD DE CIENCIAS EXACTAS   (Argentina)

^c UNIVERSITY OF EDINBURGH   (United Kingdom)

Author keywords

2,2,2 Trifluoroethyl trifluoroacetate; Ab initio calculations; DFT calculations; Gas phase electron diffraction; Infrared and Raman spectroscopy; Internal barrier to rotation

Indexed keywords

AUGER ELECTRON SPECTROSCOPY; CARBON DIOXIDE; CONFORMATIONS; DATA STRUCTURES; DENSITY FUNCTIONAL THEORY; DIFFRACTION; ELECTRON DIFFRACTION; EXPERIMENTS; PROBABILITY DENSITY FUNCTION; QUANTUM CHEMISTRY; RAMAN SCATTERING; RAMAN SPECTROSCOPY; ROTATION; SPECTRUM ANALYSIS; SULFUR COMPOUNDS;

2,2,2-TRIFLUOROETHYL TRIFLUOROACETATE; AB INITIO CALCULATIONS; DFT CALCULATIONS; INFRARED AND RAMAN SPECTROSCOPY; INTERNAL BARRIER TO ROTATION;

INFRARED SPECTROSCOPY;

EID: 58149180190     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2008.08.012     Document Type: Article

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