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Bromide complexes of bismuth with 4-bromobenzyl-substituted cations of pyridinium family. / Gorokh, Igor D.; Adonin, Sergey A.; Usoltsev, Andrey N. et al.
In: Journal of Molecular Structure, Vol. 1199, 126955, 05.01.2020.Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - Bromide complexes of bismuth with 4-bromobenzyl-substituted cations of pyridinium family
AU - Gorokh, Igor D.
AU - Adonin, Sergey A.
AU - Usoltsev, Andrey N.
AU - Novikov, Alexander S.
AU - Samsonenko, Denis G.
AU - Zakharov, Sergey V.
AU - Sokolov, Maxim N.
AU - Fedin, Vladimir P.
N1 - Publisher Copyright: © 2019 Elsevier B.V. Copyright: Copyright 2019 Elsevier B.V., All rights reserved.
PY - 2020/1/5
Y1 - 2020/1/5
N2 - Two bromobismuthate (III) complexes containing 4-bromobenzyl-substituted pyridinium cations – (1-(4-BrBz)Py)3[Bi2Br9] (1) and (1-(4-BrBz)-2-MePy)3[BiBr6] (2) – were prepared by reactions of Bi2O3 and corresponding pyridinium bromides in HBr. In the structure of 1 there are weak contacts between the Br atoms of 1-(4-BrBz)Py+ and bromide ligands of [Bi2Br9]3-, while in the case of 2 such interactions are absent. The contributions of halogen and hydrogen bonding were estimated by Hirshfeld surface analysis (HSA); additionally, energies of Br⋯Br type I halogen-halogen contacts were calculated.
AB - Two bromobismuthate (III) complexes containing 4-bromobenzyl-substituted pyridinium cations – (1-(4-BrBz)Py)3[Bi2Br9] (1) and (1-(4-BrBz)-2-MePy)3[BiBr6] (2) – were prepared by reactions of Bi2O3 and corresponding pyridinium bromides in HBr. In the structure of 1 there are weak contacts between the Br atoms of 1-(4-BrBz)Py+ and bromide ligands of [Bi2Br9]3-, while in the case of 2 such interactions are absent. The contributions of halogen and hydrogen bonding were estimated by Hirshfeld surface analysis (HSA); additionally, energies of Br⋯Br type I halogen-halogen contacts were calculated.
KW - Bismuth
KW - Halide complexes
KW - Hirshfeld surface analysis
KW - Supramolecular contacts
KW - HIRSHFELD SURFACE-ANALYSIS
KW - CRYSTAL-STRUCTURES
KW - NONCOVALENT INTERACTIONS
KW - VIBRATIONAL-SPECTRA
KW - BR
KW - TRANSITION
KW - HYBRID MATERIAL
KW - CHLOROBISMUTHATE(III)
KW - MAGNETIC-PROPERTIES
KW - HALOGEN BOND
UR - http://www.scopus.com/inward/record.url?scp=85071005408&partnerID=8YFLogxK
U2 - 10.1016/j.molstruc.2019.126955
DO - 10.1016/j.molstruc.2019.126955
M3 - Article
AN - SCOPUS:85071005408
VL - 1199
JO - Journal of Molecular Structure
JF - Journal of Molecular Structure
SN - 0022-2860
M1 - 126955
ER -
ID: 21343697