Quantitative Theoretical Predictions and Qualitative Bonding Analysis of the Divinylborinium System and Its Al, Ga, In, and Tl Congeners.
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DOI: 10.1021/acs.inorgchem.8b00968
Abstract: A substituted divinylborinium cation was synthesized recently and characterized crystallographically as a gauche structure with a 153° C1-C2-C3-C4 dihedral angle. A full theoretical geometrical optimization of the bis(2-mesityl-1,2-diphenylvinyl)-borane cation shows excellent agreement with the crystal… read more here.
Keywords: dihedral angle; analysis; quantitative theoretical; predictions qualitative ... See more keywords