Comparative study between the X-ray, DFT and Møller-Plesset structure of solid phenoxyacetohydrazide

Journal of Molecular Structure

Volumn 984, Issue 1-3, 2010, Pages 209-213

  Badawi, Hassan M ^a  

^a KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS   (Saudi Arabia)

Author keywords

Comparison between X ray and theoretical structures; Molecular structure; Phenoxyacetohydrazide; Vibrational spectra and assignments

Indexed keywords

COMPARATIVE STUDIES; CONFORMATIONAL BEHAVIOR; DFT-B3LYP; GROUND-STATE STRUCTURES; PHENOXYACETOHYDRAZIDE; PLANAR STRUCTURE; RAMAN DATA; THEORETICAL STRUCTURE; TORSIONAL ANGLE; VIBRATIONAL ASSIGNMENT; VIBRATIONAL FREQUENCIES; VIBRATIONAL SPECTRA AND ASSIGNMENTS; X-RAY STRUCTURE; X-RAY STUDIES;

CONFORMATIONS; MOLECULAR STRUCTURE; VIBRATIONAL SPECTRA;

X RAYS;

EID: 78649326296     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2010.09.029     Document Type: Article

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