The low-lying excited states of 1,6-methano[10] annulene

被引:5
|
作者
Catani, L
Gellini, C
Salvi, PR
Marconi, G
机构
[1] UNIV FLORENCE,DIPARTIMENTO CHIM,LAB SPETTROSCOPIA MOL,I-50121 FLORENCE,ITALY
[2] CNR,IST FRAE,I-40129 BOLOGNA,ITALY
关键词
electronic absorption spectra; low-lying excited states; 1,6-methanol; 10]annulene;
D O I
10.1016/S1010-6030(96)04546-7
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
The electronic absorption spectrum of 1,6-methano[10] annulene in the region of the S-0-->S-1 and S-0-->S-2 transitions was investigated at room and low temperature. By comparison with the one-photon spectrum of naphthalene, and considering pseudoparity selection rules, the strong 33 000 cm(-1) band of the annulene derivative is assigned as the inductively perturbed S-0-->S-2 (L-a(+)) electronic transition. The rich vibronic structure of the S-0-->S-1 transition at low temperature is discussed in terms of Franck-Condon allowed transitions. The calculated intensities of the fundamental modes are in qualitative agreement with the experimental data. (C) 1997 Elsevier Science S.A.
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页码:123 / 127
页数:5
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