Molecular structure and vibrational assignment of (trifluoroacetyl) acetone: A density functional study

Journal of Molecular Structure

Volumn 787, Issue 1-3, 2006, Pages 148-162

  Raissi, Heidar ^a   Nowroozi, Alireza ^b   Roozbeh, Mozhgan ^a   Farzad, Farzaneh ^a  

^a UNIVERSITY OF BIRJAND   (Iran)

^b UNIVERSITY OF SISTAN AND BALUCHESTAN   (Iran)

Author keywords

(Trifluoroacetyl) acetone; Atoms in molecules (AIM); Density functional theory; Intramolecular hydrogen bond; Vibrational spectra

Indexed keywords

FOURIER TRANSFORM INFRARED SPECTROSCOPY; HYDROGEN BONDS; MOLECULAR STRUCTURE; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; RAMAN SCATTERING;

(TRIFLUOROACETYL) ACETONE; ATOMS IN MOLECULES (AIM); INTRAMOLECULAR HYDROGEN BOND; VIBRATIONAL SPECTRA;

ACETONE;

EID: 33646158691     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2005.10.042     Document Type: Article

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