Issue 5, 2001

Planar hexacoordinated boron in organoboron compounds: an ab initio study

Abstract

Ab initio [MP2(fu)/6-31G**, MP2(fu)/6-311G**] and DFT [B3LYP/6-31G**, B3LYP/6-311G**] calculations predict stable planar structures of the nonclassical compounds BB6(CH)3 and BB6X2 (X = NH, O) containing a hexacoordinated central boron atom.

Article information

Article type
Paper

Mendeleev Commun., 2001,11, 169-170

Planar hexacoordinated boron in organoboron compounds: an ab initio study

T. N. Gribanova, R. M. Minyaev and V. I. Minkin, Mendeleev Commun., 2001, 11, 169 DOI: 10.1070/MC2001v011n05ABEH001461

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