Vibrational spectroscopy and density functional theory study of 4-mercaptophenol

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 122, Issue , 2014, Pages 698-703

  Li, Ran ^a   Ji, Wei ^a   Chen, Lei ^a   Lv, Haiming ^a,c   Cheng, Jianbo ^b   Zhao, Bing ^a  

^a Jilin University   (China)

^b YANTAI UNIVERSITY   (China)

^c HARBIN INSTITUTE OF TECHNOLOGY   (China)

Author keywords

4 Mercaptophenol; DFT; FTIR; HOMO LUMO gap; Hydrogen bond; Raman

Indexed keywords

4-MERCAPTOPHENOL; DFT; FTIR; HOMO-LUMO GAPS; RAMAN;

DENSITY FUNCTIONAL THEORY; HYDROGEN BONDS; MOLECULES; RAMAN SCATTERING;

COMPLEXATION;

4 MERCAPTOPHENOL; 4-MERCAPTOPHENOL; PHENOL DERIVATIVE; THIOL DERIVATIVE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; DFT; FTIR; HOMO-LUMO GAP; HYDROGEN BOND; INFRARED SPECTROSCOPY; QUANTUM THEORY; RAMAN; RAMAN SPECTROMETRY;

4-MERCAPTOPHENOL; DFT; FTIR; HOMO-LUMO GAP; HYDROGEN BOND; RAMAN;

MODELS, MOLECULAR; PHENOLS; QUANTUM THEORY; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SPECTRUM ANALYSIS, RAMAN; SULFHYDRYL COMPOUNDS;

EID: 84890847229     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2013.11.109     Document Type: Article

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