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• W2038738504 abstract "This work studied the bent and planar structures of M2N2 cores of a series of dinuclear early transition-metal complexes (M = Zr, Hf, Nb, Ta, Mo and W) containing a side-on bridging dinitrogen ligand using DFT method. The calculated results propose three key factors favoring a bent structure: (1) the availability of a single electron in the metal centers which leads to the bonding interaction between two metal atoms, (2) no remarkable steric effect around the metal centers, and (3) the cis conformation of the ligands in the dinitrogen dinuclear complexes. In addition, the bent and planar structures of M2N2 could be transformed into each other if the steric hindrance was slight." @default.
• W2038738504 created "2016-06-24" @default.
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• W2038738504 date "2014-06-20" @default.
• W2038738504 modified "2023-10-10" @default.
• W2038738504 title "Bent and planar structures of μ–η²:η²-N₂dinuclear early transition metal complexes" @default.
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• W2038738504 doi "https://doi.org/10.1039/c4dt00646a" @default.
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