Analysis of structure and vibrational spectra of 2,5-dihydroxybenzoicacid based on density functional theory calculations

Journal of Raman Spectroscopy

Volumn 41, Issue 4, 2010, Pages 473-478

  Krishnakumar, V ^a   Surumbarkuzhali, N ^b  

^a PERIYAR UNIVERSITY   (India)

^b GOVERNMENT ARTS COLLEGE AUTONOMOUS   (India)

Author keywords

2,5 dihydroxybenzoicacid; Density functional theory; Intramolecular hydrogen bonding; Vibrational spectra

Indexed keywords

FOURIER TRANSFORM INFRARED SPECTROSCOPY; HYDROGEN; HYDROGEN BONDS; VIBRATIONAL SPECTRA;

2,5-DIHYDROXYBENZOICACID; DENSITY-FUNCTIONAL THEORY CALCULATIONS; DENSITY-FUNCTIONAL-THEORY; DIHYDROXYBENZOIC ACIDS; FT-RAMAN; INTRAMOLECULAR HYDROGEN BONDING; NORMAL COORDINATE ANALYSIS; RAMAN MEASUREMENTS; SPECTRA'S; TOTAL-ENERGY CALCULATIONS;

DENSITY FUNCTIONAL THEORY;

EID: 77951042174     PISSN: 03770486     EISSN: 10974555     Source Type: Journal    
DOI: 10.1002/jrs.2460     Document Type: Article

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