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Planar hexacoordinated boron in organoboron compounds: an ab initio study

Tatyana N Gribanova 1
Tatyana N Gribanova
, 
Ruslan Mikhailovich Minyaev 1
Ruslan Mikhailovich Minyaev
, 
Vladimir Isaakovich Minkin 1
Vladimir Isaakovich Minkin
10.1070/MC2001v011n05ABEH001461
Published 2001-10-23
Communication , Volume 11, Issue 5, 169-170
31
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Gribanova T. N., Minyaev R. M., Minkin V. I. Planar hexacoordinated boron in organoboron compounds: an ab initio study // Mendeleev Communications. 2001. Vol. 11. No. 5. pp. 169-170.
GOST all authors (up to 50) Copy
Gribanova T. N., Minyaev R. M., Minkin V. I. Planar hexacoordinated boron in organoboron compounds: an ab initio study // Mendeleev Communications. 2001. Vol. 11. No. 5. pp. 169-170.
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TY - JOUR
DO - 10.1070/MC2001v011n05ABEH001461
UR - https://mendcomm.colab.ws/publications/10.1070/MC2001v011n05ABEH001461
TI - Planar hexacoordinated boron in organoboron compounds: an ab initio study
T2 - Mendeleev Communications
AU - Gribanova, Tatyana N
AU - Minyaev, Ruslan Mikhailovich
AU - Minkin, Vladimir Isaakovich
PY - 2001
DA - 2001/10/23
PB - Mendeleev Communications
SP - 169-170
IS - 5
VL - 11
ER -
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@article{2001_Gribanova,
author = {Tatyana N Gribanova and Ruslan Mikhailovich Minyaev and Vladimir Isaakovich Minkin},
title = {Planar hexacoordinated boron in organoboron compounds: an ab initio study},
journal = {Mendeleev Communications},
year = {2001},
volume = {11},
publisher = {Mendeleev Communications},
month = {Oct},
url = {https://mendcomm.colab.ws/publications/10.1070/MC2001v011n05ABEH001461},
number = {5},
pages = {169--170},
doi = {10.1070/MC2001v011n05ABEH001461}
}
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Gribanova, Tatyana N., et al. “Planar hexacoordinated boron in organoboron compounds: an ab initio study.” Mendeleev Communications, vol. 11, no. 5, Oct. 2001, pp. 169-170. https://mendcomm.colab.ws/publications/10.1070/MC2001v011n05ABEH001461.

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.

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