Document Detail


Refined model of optical activity of cis-dihydrodiol metabolites: role of 1,3-diene conformation in the electronic circular dichroism spectra.
MedLine Citation:
PMID:  22135803     Owner:  NLM     Status:  In-Process    
Abstract/OtherAbstract:
The effect of the secondary structural feature, that is, nonplanarity of carbon-carbon double bonds, on the rotatory strength of the long-wavelength π-π* electronic transition has been investigated for the series of monocyclic cis-dihydrodiol arene metabolites and model compounds. The contribution from nonplanar C=C bonds to the overall rotatory strength of the π-π* electronic transition is more significant than the contribution from twisted 1,3-diene chromophore. The effect of the substitution pattern in the cyclohexadiene skeleton may be decisive for the sign of the long-wavelength π-π* Cotton effect.
Authors:
Marcin Kwit; Jacek Gawronski
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Publication Detail:
Type:  Journal Article    
Journal Detail:
Title:  Chirality     Volume:  23     ISSN:  1520-636X     ISO Abbreviation:  Chirality     Publication Date:  2011 Oct 
Date Detail:
Created Date:  2011-12-01     Completed Date:  -     Revised Date:  -    
Medline Journal Info:
Nlm Unique ID:  8914261     Medline TA:  Chirality     Country:  United States    
Other Details:
Languages:  eng     Pagination:  744-51     Citation Subset:  IM    
Copyright Information:
© 2011 Wiley-Liss, Inc.
Affiliation:
Department of Chemistry, A. Mickiewicz University, Poznan 60-780, Poland. Marcin.Kwit@amu.edu.pl
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