Vibrational assignment and structure of dibenzoylmethane. A density functional theoretical study

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 66, Issue 2, 2007, Pages 394-404

  Tayyari, S F ^a   Rahemi, H ^b   Nekoei, A R ^c   Zahedi Tabrizi, M ^d   Wang, Y A ^e  

^a Ferdowsi University of Mashhad   (Iran)

^b URMIA UNIVERSITY   (Iran)

^c FERDOWSI UNIVERSITY OF MASHHAD   (Iran)

^d ALZAHRA UNIVERSITY   (Iran)

^e UNIVERSITY OF BRITISH COLUMBIA   (Canada)

Author keywords

Diketone; Dibenzoylmethane; Intramolecular hydrogen bond; NBO; Vibrational assignment

Indexed keywords

Β-DIKETONE; DIBENZOYLMETHANE; INTRAMOLECULAR HYDROGEN BOND; NATURAL BOND ORBITAL ANALYSIS (NBO); VIBRATIONAL ASSIGNMENT;

ACETONE; HYDROGEN BONDS; MOLECULAR STRUCTURE; NUCLEAR MAGNETIC RESONANCE; PROBABILITY DENSITY FUNCTION; RAMAN SCATTERING;

METHANE;

ACETYLACETONE; ALKANONE; BENZOYLACETONE; CHALCONE DERIVATIVE; DIBENZOYLMETHANE; UNCLASSIFIED DRUG;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPARATIVE STUDY; INFRARED SPECTROPHOTOMETRY; RAMAN SPECTROMETRY;

BUTANONES; CHALCONES; MODELS, MOLECULAR; PENTANONES; SPECTROPHOTOMETRY, INFRARED; SPECTRUM ANALYSIS, RAMAN;

EID: 33845880867     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2006.03.010     Document Type: Article

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