Photoinduced electron and proton transfer in the hydrogen-bonded pyridine-pyrrole system

被引：27

作者：

Frutos, Luis Manuel ^{[1
]}

Markmann, Andreas

Sobolewski, Andrzej L.

Domcke, Wolfgang

机构：

[1] Tech Univ Munich, Inst Phys & Theoret Chem, D-85747 Garching, Germany

[2] Polish Acad Sci, Inst Phys, PL-02668 Warsaw, Poland

来源：

JOURNAL OF PHYSICAL CHEMISTRY B | 2007年 / 111卷 / 22期

关键词：

D O I：

10.1021/jp0729361

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

We present here a detailed analysis of the mechanism of photoinduced electron and proton transfer in the planar pyrrole-pyridine hydrogen-bonded system, a model for the photochemistry of hydrogen bonds in DNA base pairs. Two different crossings, an avoided crossing and a conical intersection, are the key steps for forward and backward electron and proton transfer providing to the system photostability against UV radiation by restoring the system in its initial electronic and geometric structure.

引用

页码：6110 / 6112

页数：3

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