酞菁和八x杂类酞菁电子光谱的量子化学解析

The Dissection of Quantum Chemistry for Electronic Spectra of Phthalocyanine and Eight-x-Phthalocyanine

本文用群论方法和HMO法研究了酞菁和八x杂类酞菁的π电子结构,群论处理和计算结果解释了上述化合物电子光谱的产生和“光谱紧缩”现象。

Theπ electronic construction of the phthalocyanine and eight-x-phthalo-eyanjne (x means N, S atoms) has been studied by means of both group theoryand HMO methods. The "spectral contraction" phenomenon of above compoundshave been explained frpm the results of group theory disposition and Computation.