Theoretische Untersuchungen zur Molekülgeometrie, zum elektronischen Spektralverhalten und intramolekularen Donor-Akzeptorvermögen ausgewählter Diphenylchalkone

✍ Scribed by Prof. Dr. K. Gustav; Dr. R. Colditz; A. Jabs

• Publisher: John Wiley and Sons
• Year: 1990
• Tongue: English
• Weight: 400 KB
• Volume: 332
• Category: Article
• ISSN: 1615-4150
• DOI: 10.1002/prac.19903320509

✦ Synopsis

Theoretical Investigations on the Molecular Geometry, the Electronic Spectral Behaviour and the Intramolecular Donor‐Acceptor Properties of Selected Diphenyl Chalcones

Theoretical completely‐optimized S~0~ and S~1~ molecular geometries of diphenylpropenone are presented. On this basis the influence of donor substituents within the styryl and/or benzoyl moieties on the electronic spectral behaviour and the intramolecular donor‐acceptor properties has been studied. The theoretical results are interpreted in context with the experimental data.