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• W1987251818 endingPage "121" @default.
• W1987251818 startingPage "116" @default.
• W1987251818 abstract "In this account, the bonding pattern of cyclic (B6C)−2 dianion as a planar hypercoordinate carbon compound is considered employing topological charge density analysis developed within framework of Quantum Theory of Atoms in Molecules. The analysis was done on charge densities derived from post-HF methods. The outcomes of the analysis demonstrate that the nature of interactions between boron atoms and central carbon atom is a novel “non-directional shared interaction”. The intrinsic floppiness of charge density distribution in this molecule also is once again confirmed and a new approach is proposed to systematically study the role of nuclear excursions in similar molecules." @default.
• W1987251818 created "2016-06-24" @default.
• W1987251818 creator A5016333886 @default.
• W1987251818 creator A5071135874 @default.
• W1987251818 date "2007-11-01" @default.
• W1987251818 modified "2023-09-27" @default.
• W1987251818 title "Ab initio post-HF study of electronic charge density distribution of cyclic (B6C)−2: Concrete evidence of a novel bonding pattern" @default.
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• W1987251818 doi "https://doi.org/10.1016/j.theochem.2007.08.011" @default.
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