A study of hydrogen bond of imidazole and its 4-nitro derivative by ab initio and DFT calculated NQR parameters

Chemical Physics Letters

Volumn 391, Issue 1-3, 2004, Pages 95-100

  Amini, S K ^a   Hadipour, N L ^a   Elmi, F ^a  

^a TARBIAT MODARES UNIVERSITY   (Iran)

Author keywords

[No Author keywords available]

Indexed keywords

4 NITROIMIDAZOLE; IMIDAZOLE;

AB INITIO CALCULATION; ARTICLE; DATA ANALYSIS; DENSITY FUNCTIONAL THEORY; DRUG STRUCTURE; HYDROGEN BOND; NEUTRON DIFFRACTION; STRUCTURE ACTIVITY RELATION; STRUCTURE ANALYSIS; TEMPERATURE DEPENDENCE; X RAY ANALYSIS;

EID: 2542500632     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.04.065     Document Type: Article

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