Takahashi Masae
Department of Physics, Graduate School of Science, Tohoku University, Sendai 980-8578, Japan.
Molecules. 2025 Mar 4;30(5):1158. doi: 10.3390/molecules30051158.
This article provides a comprehensive review of quantum chemical computational studies on the thermal and photochemical reactions of organosilicon compounds, based on fundamental concepts such as initial complex formation, HOMO-LUMO interactions, and subjacent orbital interactions. Despite silicon's position in group 14 of the periodic table, alongside carbon, its reactivity patterns exhibit significant deviations from those of carbon. This review delves into the reactivity behaviors of organosilicon compounds, particularly focusing on the highly coordinated nature of silicon. It is poised to serve as a valuable resource for chemists, offering insights into cutting-edge research and fostering further innovations in synthetic chemistry and also theoretical chemistry.
本文基于初始络合物形成、HOMO-LUMO相互作用和相邻轨道相互作用等基本概念,对有机硅化合物的热反应和光化学反应的量子化学计算研究进行了全面综述。尽管硅在元素周期表第14族中与碳处于同一位置,但其反应模式与碳的反应模式存在显著差异。本综述深入探讨了有机硅化合物的反应行为,尤其关注硅的高配位性质。它有望成为化学家的宝贵资源,为前沿研究提供见解,并促进合成化学以及理论化学的进一步创新。