Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations: Structures, thermal stability and features of halogen⋯halogen contacts in solid state

Sergey A. Adonin; Mikhail A. Bondarenko; Alexander S. Novikov; Pavel E. Plyusnin; Ilya V. Korolkov; Maxim N. Sokolov; Vladimir P. Fedin

doi:10.1016/j.ica.2019.119278

Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations: Structures, thermal stability and features of halogen⋯halogen contacts in solid state

Sergey A. Adonin, Mikhail A. Bondarenko, Alexander S. Novikov, Pavel E. Plyusnin, Ilya V. Korolkov, Maxim N. Sokolov, Vladimir P. Fedin

Research output: Contribution to journal › Article › peer-review

2 Citations (Scopus)

Abstract

Reactions of Sb₂O₃ solution in HBr in presence of Br₂ with series of pyridinium-type cation salts resulted in formation of Cat[SbBr₆] (Cat = 1,3,4-MePy⁺ (1) and 1,4-MePy⁺ (2)) and Cat₂{[SbBr₆](Br₃)} (Cat = 1,2-MePy⁺ (3), 1-Et-2-MePy⁺ (4) and 1-Et-4-MePy⁺ (5)) complexes which were characterized by X-ray diffractometry. For all compounds, thermal stability was investigated by TGA method; energies of non-covalent Br⋯Br interactions were estimated by DFT calculations and QTAIM analysis (M06/DZP-DKH level of theory).

Original language	English
Article number	119278
Number of pages	8
Journal	Inorganica Chimica Acta
Volume	502
Early online date	16 Nov 2019
DOIs	https://doi.org/10.1016/j.ica.2019.119278
Publication status	Published - 1 Mar 2020

Keywords

Antimony
Halide complexes
Halogen bonding
Polyhalogens
Supramolecular contacts
ANIONS
INTERPLAY
VAN
CRYSTAL-STRUCTURE
NONCOVALENT INTERACTIONS
RADII
LIQUID-BASED SYNTHESIS
ZETA BASIS-SETS

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10.1016/j.ica.2019.119278

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Adonin, S. A., Bondarenko, M. A., Novikov, A. S., Plyusnin, P. E., Korolkov, I. V., Sokolov, M. N., & Fedin, V. P. (2020). Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations: Structures, thermal stability and features of halogen⋯halogen contacts in solid state. Inorganica Chimica Acta, 502, [119278]. https://doi.org/10.1016/j.ica.2019.119278

Adonin, Sergey A. ; Bondarenko, Mikhail A. ; Novikov, Alexander S. ; Plyusnin, Pavel E. ; Korolkov, Ilya V. ; Sokolov, Maxim N. ; Fedin, Vladimir P. / Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations : Structures, thermal stability and features of halogen⋯halogen contacts in solid state. In: Inorganica Chimica Acta. 2020 ; Vol. 502.

@article{ba4eb633b0c14003a5905e71c77b840a,

title = "Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations: Structures, thermal stability and features of halogen⋯halogen contacts in solid state",

abstract = "Reactions of Sb2O3 solution in HBr in presence of Br2 with series of pyridinium-type cation salts resulted in formation of Cat[SbBr6] (Cat = 1,3,4-MePy+ (1) and 1,4-MePy+ (2)) and Cat2{[SbBr6](Br3)} (Cat = 1,2-MePy+ (3), 1-Et-2-MePy+ (4) and 1-Et-4-MePy+ (5)) complexes which were characterized by X-ray diffractometry. For all compounds, thermal stability was investigated by TGA method; energies of non-covalent Br⋯Br interactions were estimated by DFT calculations and QTAIM analysis (M06/DZP-DKH level of theory).",

keywords = "Antimony, Halide complexes, Halogen bonding, Polyhalogens, Supramolecular contacts, ANIONS, INTERPLAY, VAN, CRYSTAL-STRUCTURE, NONCOVALENT INTERACTIONS, RADII, LIQUID-BASED SYNTHESIS, ZETA BASIS-SETS",

author = "Adonin, {Sergey A.} and Bondarenko, {Mikhail A.} and Novikov, {Alexander S.} and Plyusnin, {Pavel E.} and Korolkov, {Ilya V.} and Sokolov, {Maxim N.} and Fedin, {Vladimir P.}",

year = "2020",

month = mar,

day = "1",

doi = "10.1016/j.ica.2019.119278",

language = "English",

volume = "502",

journal = "Inorganica Chimica Acta",

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Adonin, SA, Bondarenko, MA, Novikov, AS, Plyusnin, PE, Korolkov, IV, Sokolov, MN & Fedin, VP 2020, 'Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations: Structures, thermal stability and features of halogen⋯halogen contacts in solid state', Inorganica Chimica Acta, vol. 502, 119278. https://doi.org/10.1016/j.ica.2019.119278

Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations : Structures, thermal stability and features of halogen⋯halogen contacts in solid state. / Adonin, Sergey A.; Bondarenko, Mikhail A.; Novikov, Alexander S.; Plyusnin, Pavel E.; Korolkov, Ilya V.; Sokolov, Maxim N.; Fedin, Vladimir P.

In: Inorganica Chimica Acta, Vol. 502, 119278, 01.03.2020.

Research output: Contribution to journal › Article › peer-review

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AU - Adonin, Sergey A.

AU - Bondarenko, Mikhail A.

AU - Novikov, Alexander S.

AU - Plyusnin, Pavel E.

AU - Korolkov, Ilya V.

AU - Sokolov, Maxim N.

AU - Fedin, Vladimir P.

PY - 2020/3/1

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N2 - Reactions of Sb2O3 solution in HBr in presence of Br2 with series of pyridinium-type cation salts resulted in formation of Cat[SbBr6] (Cat = 1,3,4-MePy+ (1) and 1,4-MePy+ (2)) and Cat2{[SbBr6](Br3)} (Cat = 1,2-MePy+ (3), 1-Et-2-MePy+ (4) and 1-Et-4-MePy+ (5)) complexes which were characterized by X-ray diffractometry. For all compounds, thermal stability was investigated by TGA method; energies of non-covalent Br⋯Br interactions were estimated by DFT calculations and QTAIM analysis (M06/DZP-DKH level of theory).

AB - Reactions of Sb2O3 solution in HBr in presence of Br2 with series of pyridinium-type cation salts resulted in formation of Cat[SbBr6] (Cat = 1,3,4-MePy+ (1) and 1,4-MePy+ (2)) and Cat2{[SbBr6](Br3)} (Cat = 1,2-MePy+ (3), 1-Et-2-MePy+ (4) and 1-Et-4-MePy+ (5)) complexes which were characterized by X-ray diffractometry. For all compounds, thermal stability was investigated by TGA method; energies of non-covalent Br⋯Br interactions were estimated by DFT calculations and QTAIM analysis (M06/DZP-DKH level of theory).

KW - Antimony

KW - Halide complexes

KW - Halogen bonding

KW - Polyhalogens

KW - Supramolecular contacts

KW - ANIONS

KW - INTERPLAY

KW - VAN

KW - CRYSTAL-STRUCTURE

KW - NONCOVALENT INTERACTIONS

KW - RADII

KW - LIQUID-BASED SYNTHESIS

KW - ZETA BASIS-SETS

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U2 - 10.1016/j.ica.2019.119278

DO - 10.1016/j.ica.2019.119278

M3 - Article

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VL - 502

JO - Inorganica Chimica Acta

JF - Inorganica Chimica Acta

SN - 0020-1693

M1 - 119278

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