A theoretical study on the vibrational spectra and thermodynamic properties for the nitro derivatives of phenols

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 74, Issue 2, 2009, Pages 569-574

  Wang, Gui xiang ^a   Gong, Xue dong ^a   Liu, Yan ^a   Xiao, He ming ^a  

^a NANJING UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

Author keywords

Density functional theory; IR spectra; Nitro derivative of phenols; Thermodynamic property

Indexed keywords

GROUP ADDITIVITY; HYDROXY GROUPS; IR SPECTRA; IR SPECTRUM; MOLECULAR GEOMETRIES; NITRO DERIVATIVE OF PHENOLS; THEORETICAL STUDY; VIBRATIONAL ANALYSIS;

ELECTRONIC STRUCTURE; PHENOLS; THERMODYNAMIC PROPERTIES;

DENSITY FUNCTIONAL THEORY;

PHENOL DERIVATIVE;

ARTICLE; INFRARED SPECTROPHOTOMETRY; THERMODYNAMICS;

PHENOLS; SPECTROPHOTOMETRY, INFRARED; THERMODYNAMICS;

EID: 69249203558     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2009.07.013     Document Type: Article

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