The g values of some halomolybdenyl, -vanadyl, and -chromyl complexes.
The principal g values of a series of [MOXn]m- (M = VIV, CrV, MoV; X = F-, Cl-, Br-; n = 4, 5; m = 1, 2, 3) complexes are calculated by the INDO-CI-Stone method. The results agree well with the experimental data and reveal that the traditional models have some limitations in calculating g values for some complexes of this type.
D002840:Chromates / Q000737:chemistry*; D006801:Humans; D007477:Ions; D008958:Models, Molecular; D008968:Molecular Conformation; D008982:Molybdenum / Q000737:chemistry*; D013329:Structure-Activity Relationship; D014638:Vanadates / Q000737:chemistry*