Experimental and theoretical study on IR and NMR spectra of several tetrachlorinated diphenyl sulfides

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 81, Issue 1, 2011, Pages 261-269

  Qu, Ruijuan ^a   Zhang, Xuesheng ^a   Zhang, Qi ^a   Yang, Xi ^a   Wang, Zunyao ^a   Wang, Liansheng ^a  

^a NANJING UNIVERSITY   (China)

Author keywords

B3LYP; IR; NMR chemical shifts; Tetrachlorinated diphenyl sulfides

Indexed keywords

B3LYP; EXPERIMENTAL VALUES; GAUSSIANS; IR AND NMR SPECTRA; NMR CHEMICAL SHIFTS; OPTIMIZED GEOMETRIES; SPECTRAL PARAMETERS; TETRACHLORINATED DIPHENYL SULFIDES; THEORETICAL STUDY; VIBRATION FREQUENCY;

IRIDIUM; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

CHEMICAL SHIFT;

CHLOROBENZENE; PHENYL SULFIDE; SULFIDE;

ARTICLE; BIOLOGICAL MODEL; CHEMISTRY; CONFORMATION; INFRARED SPECTROSCOPY; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; THEORETICAL MODEL; VIBRATION;

CHEMISTRY, ANALYTIC; CHLOROBENZENES; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, BIOLOGICAL; MODELS, THEORETICAL; MOLECULAR CONFORMATION; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SULFIDES; VIBRATION;

EID: 80052941400     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2011.06.008     Document Type: Article

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