Spectroscopic Study of Hydrogen Bonded7-Azaindole Clusters

Laser Chemistry Pub Date : 1900-01-01 DOI:10.1155/1995/63470
A. Nakajima, F. Ono, Y. Kihara, A. Ogawa, K. Matsubara, K. Ishikawa, M. Baba, K. Kaya
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引用次数: 15

Abstract

The geometric structures of 7-azaindole (7-AzI) and its dimer were investigated by laser-induced fluorescence (LIF). The rotationally resolved LIF spectrum (resolution: ∼0.00003 cm-1 of 7-AzI monomer shows that (i) rotational constants are A′′ 0.13082(5), B′′ = 0.05677(2), C′′ = 0.03970(1), A′ = 0.12468(5), B′ = 0.056752(2), and C′ = 0.03911(1), and (ii) the transition dipole moment direction is tilted at an angle of ± 21(5) degrees with respect to a axis. The LIF spectrum (resolution: ∼0.06 cm-1) of the nonreactive 7-AzI dimer suggests there are three possibilities for the geometric structure, having “single bonded”, “T-shaped”, and “non-planar” structures.
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氢键7-叠氮都乐簇的光谱研究
用激光诱导荧光(LIF)研究了7-叠氮杂酚(7-AzI)及其二聚体的几何结构。7-AzI单体的旋转分辨LIF光谱(分辨率:~ 0.00003 cm-1)表明:(i)旋转常数为A′= 0.13082(5),B′= 0.05677(2),C′= 0.03970(1),A′= 0.12468(5),B′= 0.056752(2),C′= 0.03911(1),(ii)跃迁偶极矩方向相对于轴倾斜±21(5)度。非反应性7-AzI二聚体的LIF光谱(分辨率:~ 0.06 cm-1)表明其几何结构有三种可能,分别为“单键”、“t形”和“非平面”结构。
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