Mechanism and dynamics of azobenzene photoisomerization

被引:294
作者
Schultz, T
Quenneville, J
Levine, B
Toniolo, A
Martínez, TJ
Lochbrunner, S
Schmitt, M
Shaffer, JP
Zgierski, MZ
Stolow, A
机构
[1] Natl Res Council Canada, Steacie Inst Mol Sci, Ottawa, ON K1N 0R6, Canada
[2] Univ Illinois, Dept Chem, Urbana, IL 61801 USA
关键词
D O I
10.1021/ja021363x
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The excited-state dynamics of trans-azobenzene were investigated by femtosecond time-resolved photoelectron spectroscopy and ab initio molecular dynamics. Two near-degenerate ππ* excited states, S2 and S3,4, were identified in a region hitherto associated with only one excited state. These results help to explain contradictory reports about the photoisomerization mechanism and the wavelength dependence of the quantum yield. A new model for the isomerization mechanism is proposed. Copyright © 2003 American Chemical Society.
引用
收藏
页码:8098 / 8099
页数:2
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