Theoretical studies on tautomerism and IR spectra of C-5 substituted imidazoles

Journal of Molecular Structure

Volumn 565-566, Issue , 2001, Pages 107-113

  Kurzepa, Małgorzata ^a   Dobrowolski, Jan Cz ^a,b   Mazurek, Aleksander P ^a  

^a NATIONAL MEDICINES INSTITUTE   (Poland)

^b INDUSTRIAL CHEMISTRY RESEARCH INSTITUTE   (Poland)

Author keywords

Ab initio; Imidazole; IR; MP2; RHF; Tautomerism

Indexed keywords

5 CARBOXYIMIDAZOLE; 5 DIHYDROBOROIMIDAZOLE; AMMONIUM DERIVATIVE; BORON DERIVATIVE; CARBOXYLIC ACID; FLUORIDE; HYDROXYL GROUP; IMIDAZOLE; NITRITE; UNCLASSIFIED DRUG;

CALCULATION; CHEMICAL INTERACTION; CHEMICAL STRUCTURE; CONFERENCE PAPER; CONFORMATIONAL TRANSITION; ENERGY TRANSFER; ENTHALPY; INFRARED SPECTROMETRY; MOLECULAR STABILITY; PROTON TRANSPORT; SOLVATION;

EID: 0035972661     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-2860(01)00498-7     Document Type: Conference Paper

References (21)