过渡金属配合物结构理论中,目前应用最广的是晶体场-配位场理论和分子轨道理论。应用分子轨道理论处理配位化合物原则上是最优越的,但为了得到每个分子轨道的构成和能量,通常需进行冗长复杂的计算,而且从一个配合物所得的结果一般不适用于别的配合物。同 Transition metal complexes structure theory, the most widely used is the crystal field - ligand field theory and molecular orbital theory. The application of molecular orbital theory to deal with coordination compounds is in principle the most superior, but in order to get the composition and energy of each molecular orbital, it usually takes a long and complicated calculation, and the results obtained from one complex are generally not suitable for other complexes Things. with