The SO potential of stilbcne has minima in the trarls (t) and cis (c) confiiuntions and a maximum in the pfrp @) configuration. The St potential has minima at t, p and c due to crossing of the \*B, snd t As potentials. and it is proposed that the Tt potential has similar minima due to crossing of th
On the dimensionality of stilbene isomerization
โ Scribed by N.S. Park; D.H. Waldeck
- Publisher
- Elsevier Science
- Year
- 1990
- Tongue
- English
- Weight
- 524 KB
- Volume
- 168
- Category
- Article
- ISSN
- 0009-2614
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โฆ Synopsis
Stilbene photoisomerizabon is a useful model system for the investigation of condensed phase reaction dynamics. This manuscript presents data on the photoisomerization of meta-methyl-substituted stilbenes in decane as a function of temperature. These kinetic data indicate that the torsional motion around the bond joining the phenyl ring to the ethylenic carbon occurs on timescales similar to trans to cis photoisomerization. The results for this model system and previous spectroscopic results suggest that a one-dimensional reaction coordinate may not be appropriate in describing stilbene isomerization.
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## Abstract Using our recently proposed quantum chemical model to simulate the effect of external forces acting on a molecule (Wolinski and Baker, Mol Phys 2009, 107, 2403), which we subsequently termed enforced geometry optimization (EGO), we investigate structural isomerism in C~14~H~12~, startin