E-2-Benzylidenebenzocycloalkanones III. Studies on transmission of substituent effects on IR carbonyl stretching frequencies and 13C NMR chemical shifts of E-2-(X-benzylidene)-1-indanones. Comparison with the IR data of E-2-(X-benzylidene)-1-indanones, -tetralones, and -benzosuberones

Journal of Molecular Structure

Volumn 697, Issue 1-3, 2004, Pages 41-47

  Perjési, Pál ^a   Perjéssy, Alexander ^b   Kolehmainen, Erkki ^c   Osz, Erzsébet ^a   Samaliková, Maria ^b   Linnanto, Juha ^c   Virtanen, Elina ^c  

^a UNIVERSITY OF PÉCS   (Hungary)

^b Physics and Informatics   (Slovakia)

^c UNIVERSITY OF JYVÄSKYLÄ   (Finland)

Author keywords

13C NMR; E 2 Benzylidene benzosuberones; E 2 Benzylideneindanones; E 2 Benzylidenetetralones; IR; Molecular modeling; Transmission of substituent effects

Indexed keywords

CARBONYL DERIVATIVE; CHALCONE DERIVATIVE; INDANONE DERIVATIVE;

AB INITIO CALCULATION; ARTICLE; CARBON NUCLEAR MAGNETIC RESONANCE; GEOMETRY; INFRARED SPECTROSCOPY; MOLECULAR DYNAMICS; QUANTUM MECHANICS; THEORETICAL STUDY;

EID: 2942559177     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2004.02.006     Document Type: Article

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