Sp. Ionov et Nt. Kuznetsov, New regularities discovered in properties of boranes with different numberof electrons and degree of their localization. Dicarboranes, RUSS J C CH, 27(9), 2001, pp. 605-612
New regularities were established for the properties of dicarboranes and th
eir anions depending on the number of electrons and electronegativities of
substituents. The property changes are quantitatively related to the degree
of localization of the electron density on chemical bonds, such localizati
on being determined by the energetics of the molecule. The conclusions made
are based on the results of quantum-chemical calculations using the struct
ural thermodynamic model.