Green Malcolm L H, Parkin Gerard
Inorganic Chemistry Laboratory, South Parks Road, Oxford, UK OX1 3QR.
Dalton Trans. 2016 Dec 21;45(47):18784-18795. doi: 10.1039/c6dt03570a. Epub 2016 Nov 15.
This article provides a means to classify and represent compounds that feature 3-center 4-electron (3c-4e) interactions in terms of the number of electrons that each atom contributes to the interaction. Specifically, Class I 3c-4e interactions are classified as those in which two atoms provide one electron each and the third atom provides a pair of electrons (i.e. LX), while Class II 3c-4e interactions are classified as those in which two atoms each provide a pair of electrons and the third atom contributes none (i.e. LZ). These classes can be subcategorized according to the nature of the central atom. Thus, Class I interactions can be categorized according to whether the central atom provides one (i.e.μ-X) or two (i.e.μ-L) electrons, while Class II interactions can be categorized according to whether the central atom provides none (i.e.μ-Z) or two (i.e.μ-L) electrons. The use of appropriate structure-bonding representations for these various interactions provides a means to determine the covalent bond classification of the element of interest.
本文提供了一种方法,可根据每个原子对三中心四电子(3c-4e)相互作用贡献的电子数,对具有这种相互作用的化合物进行分类和表示。具体而言,I类3c-4e相互作用被分类为两个原子各提供一个电子,第三个原子提供一对电子的情况(即LX),而II类3c-4e相互作用被分类为两个原子各提供一对电子且第三个原子不贡献电子的情况(即LZ)。这些类别可根据中心原子的性质进一步细分。因此,I类相互作用可根据中心原子提供一个电子(即μ-X)还是两个电子(即μ-L)进行分类,而II类相互作用可根据中心原子不提供电子(即μ-Z)还是提供两个电子(即μ-L)进行分类。对这些不同相互作用使用适当的结构-键合表示法,提供了一种确定感兴趣元素共价键分类的方法。