Infrared, density-functional theory, and atoms in molecules method studies on conformers of some 2-substituted 1H-pyrroles

Journal of Physical Chemistry A

Volumn 107, Issue 41, 2003, Pages 8723-8729

  Dubis, Alina T ^a   Grabowski, Slawomir J ^b  

^a UNIVERSITY OF BIALYSTOK   (Poland)

^b UNIVERSITY OF LODZ   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

CONFORMATIONS; HYDROGEN BONDS; INFRARED SPECTROSCOPY; MOLECULAR DYNAMICS; MOLECULAR SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; PROBABILITY DENSITY FUNCTION;

CONFORMERS; DENSITY FUNCTIONAL THEORY; MOLECULES METHOD; PYRROLES;

ORGANIC COMPOUNDS;

EID: 0242306141     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp030554z     Document Type: Article

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