FT-IR and FT-Raman investigation, computed vibrational intensity analysis and computed vibrational frequency analysis on m-Xylol using ab-initio HF and DFT calculations

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 79, Issue 5, 2011, Pages 948-955

  Prabhu, T ^a   Periandy, S ^b   Ramalingam, S ^a  

^a A V C COLLEGE AUTONOMOUS   (India)

^b Tagore Arts College   (India)

Author keywords

DFT analysis; FT IR; FT Raman; Hartree fock; m Xylol; Substituted benzenes; Vibrational frequencies

Indexed keywords

DFT ANALYSIS; FT-IR; FT-RAMAN; HARTREE-FOCK; M-XYLOL; SUBSTITUTED BENZENES;

AROMATIC POLYMERS; BENZENE; FUNCTIONAL GROUPS; MOLECULAR PHYSICS; RAMAN SPECTROSCOPY;

VIBRATION ANALYSIS;

3 XYLENE; 3-XYLENE; XYLENE;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; INFRARED SPECTROSCOPY; QUANTUM THEORY; RAMAN SPECTROMETRY; VIBRATION;

MODELS, CHEMICAL; MOLECULAR STRUCTURE; QUANTUM THEORY; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SPECTRUM ANALYSIS, RAMAN; VIBRATION; XYLENES;

EID: 79960231695     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2011.04.001     Document Type: Article

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