Theoretical studies on tautomerism and IR spectra of pyrazole derivatives

Journal of Molecular Structure: THEOCHEM

Volumn 673, Issue 1-3, 2004, Pages 17-28

  Jarończyk, 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; IR; MP2; Pyrazoles; Tautomerism

Indexed keywords

IMIDAZOLE DERIVATIVE; PYRAZOLE DERIVATIVE;

ARTICLE; ELECTRON TRANSPORT; ENERGY TRANSFER; INFRARED SPECTROSCOPY; MATHEMATICAL COMPUTING; THEORETICAL STUDY; X RAY DIFFRACTION;

EID: 18744424879     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2003.11.033     Document Type: Article

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