生命物质铁卟啉活性部位分子轨道的群论处理

Treating by Group Theory to the Molecular Orbitals of Active Site in Vital Key Substance Iron Porphyrin

关键词:  铁卟啉  分子轨道  生化性质  电子光谱  群论

Key words:  iron porphyrin  molecular orbital  biochemistry properties  electron spectrum  group theory

摘要:

用群论寻找可约表示特征标的规则、群论的对可约表示约化的公式、群论关于属于同一不可约表示的基才能对称性匹配组合分子轨道等方法、原理处理生命的关键物质铁卟啉活性部位的分子轨道。分析分子轨道能级与生化性质和电子光谱的关系。

Abstract:

The determination rule of reducible representation character of group theory,the reduction formula of reducible representation of group theory,the principle on only the bases for common a irreducible representation can compose the molecular orbitals,etc,are applied to treating the molecular orbitals of active site in vital key substance iron porphyrin.The relationship between the molecular orbitals energy levels and the biochemistry properties,electron spectrum are discussed.