Normal coordinate analysis and vibrational spectroscopy (FT-IR and FT-Raman) studies of (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid using ab initio HF and DFT method

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 99, Issue , 2012, Pages 90-96

  Prabakaran, A ^b,c   Muthu, S ^a  

^a SRI VENKATESWARA COLLEGE OF ENGINEERING   (India)

^b Pallavan College of Engineering   (India)

^c BHARATHIAR UNIVERSITY   (India)

Author keywords

First order hyperpolarizability; HOMO LUMO; NBO; NCA; UV; Vibrational spectra

Indexed keywords

HOMO-LUMO; HYPER-POLARIZABILITY; NBO; NCA; UV;

CALCULATIONS; CHARGE TRANSFER; CONTINUUM MECHANICS; MOLECULES; QUANTUM THEORY; RAMAN SCATTERING; VIBRATIONAL SPECTRA;

AROMATIC POLYMERS;

(2S) 2 AMINO 3 (3,4 DIHYDROXYPHENYL) 2 METHYLPROPANOIC ACID; (2S)-2-AMINO-3-(3,4-DIHYDROXYPHENYL)-2-METHYLPROPANOIC ACID; 2 AMINO 2 METHYLPROPIONIC ACID;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; INFRARED SPECTROSCOPY; QUANTUM THEORY; RAMAN SPECTROMETRY; THERMODYNAMICS;

AMINOISOBUTYRIC ACIDS; MODELS, MOLECULAR; QUANTUM THEORY; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SPECTRUM ANALYSIS, RAMAN; THERMODYNAMICS;

EID: 84867019090     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2012.09.014     Document Type: Article

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