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本文用HMO和图论方法,计算了端基和侧基配位的单核与双核过渡金属分子氮络合物的稳定化能量和氮原子上的电荷密度,并进行了比较,用所得出的结论解释了某些实验结果。
In this paper, the stabilization energies and the charge density on the nitrogen atom of mononuclear and dinuclear transition metal complexes with terminal and side groups coordinated by HMO and graph theory are calculated and compared. The conclusion explains some of the experimental results.