3-(4-Bromo-phen-yl)-5-(4-dimethyl-amino-phen-yl)-1-phenyl-2-pyrazoline: X-ray and density functional theory (DFT) studies

Acta Crystallographica Section C: Crystal Structure Communications

Volumn 63, Issue 6, 2007, Pages

  Langer, Vratislav ^a   Scholtzová, Eva ^b   Koóš, Miroslav ^b  

^a CHALMERS UNIVERSITY OF TECHNOLOGY   (Sweden)

^b INSTITUTE OF CHEMISTRY   (Slovakia)

Author keywords

[No Author keywords available]

Indexed keywords

CRYSTAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; HYDROGEN BONDS; STABILIZATION;

AROMATIC RINGS; NATURAL BOND ORDER; PYRAZOLINE;

CHROMOPHORES;

3 (4 BROMOPHENYL) 5 (4 DIMETHYLAMINOPHENYL) 1 PHENYL 2 PYRAZOLINE; 3-(4-BROMOPHENYL)-5-(4-DIMETHYLAMINOPHENYL)-1-PHENYL-2-PYRAZOLINE; PYRAZOLE DERIVATIVE; UNCLASSIFIED DRUG;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; HYDROGEN BOND; MATHEMATICAL COMPUTING; X RAY CRYSTALLOGRAPHY; X RAY DIFFRACTION;

CRYSTALLOGRAPHY, X-RAY; HYDROGEN BONDING; MATHEMATICAL COMPUTING; MODELS, MOLECULAR; MOLECULAR CONFORMATION; PYRAZOLES; X-RAY DIFFRACTION;

EID: 34250019179     PISSN: 01082701     EISSN: 01082701     Source Type: Journal    
DOI: 10.1107/S0108270107020689     Document Type: Article

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