Conformational analysis, tautomerization, IR, Raman, and NMR studies of 3-phenylazo-2,4-pentanedione

Journal of Molecular Structure

Volumn 920, Issue 1-3, 2009, Pages 301-309

  Tayyari, Sayyed Faramarz ^a   Sammelson, Robert Erik ^b   Tayyari, Fariba ^b   Rahemi, Hedayat ^c   Ebrahimi, Maryam ^d  

^a FERDOWSI UNIVERSITY OF MASHHAD   (Iran)

^b BALL STATE UNIVERSITY   (United States)

^c URMIA UNIVERSITY   (Iran)

^d UNIVERSITY OF WATERLOO   (Canada)

Author keywords

3 Phenylazo 2,4 pentanedione; Density functional theory; Intramolecular hydrogen bond; Tautomerization; Vibrational spectra

Indexed keywords

AMINES; BINDING SITES; DEUTERIUM; FARM BUILDINGS; HYDROGEN; HYDROGEN BONDS; MOLECULAR SPECTROSCOPY; PROGRAMMING THEORY; VIBRATIONAL SPECTRA;

3-PHENYLAZO-2,4-PENTANEDIONE; AB-INITIO CALCULATIONS; CONFORMATIONAL ANALYSIS; DENSITY-FUNCTIONAL THEORIES; DICARBONYL COMPOUNDS; EXPERIMENTAL DATUM; GAS-PHASE; HARMONIC VIBRATIONAL FREQUENCIES; INTRAMOLECULAR HYDROGEN BOND; NMR STUDIES; STABLE CONFORMERS; TAUTOMERIZATION; THEORETICAL CALCULATIONS;

DENSITY FUNCTIONAL THEORY;

EID: 59749089331     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2008.11.020     Document Type: Article

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