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Chlorotellurate(iv) supramolecular associates with "trapped" Br2 : Features of non-covalent halogen⋯halogen interactions in crystalline phases. / Usoltsev, Andrey N.; Adonin, Sergey A.; Novikov, Alexander S.; Abramov, Pavel A.; Sokolov, Maxim N.; Fedin, Vladimir P.

в: CrystEngComm, Том 22, № 11, 21.03.2020, стр. 1985-1990.

Результаты исследований: Научные публикации в периодических изданияхстатьяРецензирование

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Author

Usoltsev, Andrey N. ; Adonin, Sergey A. ; Novikov, Alexander S. ; Abramov, Pavel A. ; Sokolov, Maxim N. ; Fedin, Vladimir P. / Chlorotellurate(iv) supramolecular associates with "trapped" Br2 : Features of non-covalent halogen⋯halogen interactions in crystalline phases. в: CrystEngComm. 2020 ; Том 22, № 11. стр. 1985-1990.

BibTeX

@article{ca8373f21aed44bea51b2933d7c8408f,
title = "Chlorotellurate(iv) supramolecular associates with {"}trapped{"} Br2: Features of non-covalent halogen⋯halogen interactions in crystalline phases",
abstract = "Reactions of chlorotellurates(iv) and Br2 afford formation of one-dimensional supramolecular complexes of general formula Cat2{[TeCl6](Br2)} (Cat = Me3N+ (1), PyH+ (2), 4-MePyH+ (3) and 1-MePy+ (4)) where dibromine fragments are {"}trapped{"} by [TeCl6]3-via specific Br⋯Cl interactions (halogen bonding). The energies of the latter were estimated by DFT calculations (up to 5.7 kcal mol-1).",
keywords = "ZETA BASIS-SETS, PHENYLTRIMETHYLAMMONIUM SALTS, MOLECULAR-STRUCTURE, BOND DONOR, CENTER-DOT, COMPLEXES, BROMINE, INTERPLAY, NETWORKS, STABILIZATION",
author = "Usoltsev, {Andrey N.} and Adonin, {Sergey A.} and Novikov, {Alexander S.} and Abramov, {Pavel A.} and Sokolov, {Maxim N.} and Fedin, {Vladimir P.}",
year = "2020",
month = mar,
day = "21",
doi = "10.1039/c9ce01820d",
language = "English",
volume = "22",
pages = "1985--1990",
journal = "CrystEngComm",
issn = "1466-8033",
publisher = "Royal Society of Chemistry",
number = "11",

}

RIS

TY - JOUR

T1 - Chlorotellurate(iv) supramolecular associates with "trapped" Br2

T2 - Features of non-covalent halogen⋯halogen interactions in crystalline phases

AU - Usoltsev, Andrey N.

AU - Adonin, Sergey A.

AU - Novikov, Alexander S.

AU - Abramov, Pavel A.

AU - Sokolov, Maxim N.

AU - Fedin, Vladimir P.

PY - 2020/3/21

Y1 - 2020/3/21

N2 - Reactions of chlorotellurates(iv) and Br2 afford formation of one-dimensional supramolecular complexes of general formula Cat2{[TeCl6](Br2)} (Cat = Me3N+ (1), PyH+ (2), 4-MePyH+ (3) and 1-MePy+ (4)) where dibromine fragments are "trapped" by [TeCl6]3-via specific Br⋯Cl interactions (halogen bonding). The energies of the latter were estimated by DFT calculations (up to 5.7 kcal mol-1).

AB - Reactions of chlorotellurates(iv) and Br2 afford formation of one-dimensional supramolecular complexes of general formula Cat2{[TeCl6](Br2)} (Cat = Me3N+ (1), PyH+ (2), 4-MePyH+ (3) and 1-MePy+ (4)) where dibromine fragments are "trapped" by [TeCl6]3-via specific Br⋯Cl interactions (halogen bonding). The energies of the latter were estimated by DFT calculations (up to 5.7 kcal mol-1).

KW - ZETA BASIS-SETS

KW - PHENYLTRIMETHYLAMMONIUM SALTS

KW - MOLECULAR-STRUCTURE

KW - BOND DONOR

KW - CENTER-DOT

KW - COMPLEXES

KW - BROMINE

KW - INTERPLAY

KW - NETWORKS

KW - STABILIZATION

UR - http://www.scopus.com/inward/record.url?scp=85082024056&partnerID=8YFLogxK

UR - https://www.mendeley.com/catalogue/e64f3069-0683-3ef1-b38b-8434a08b122d/

U2 - 10.1039/c9ce01820d

DO - 10.1039/c9ce01820d

M3 - Article

AN - SCOPUS:85082024056

VL - 22

SP - 1985

EP - 1990

JO - CrystEngComm

JF - CrystEngComm

SN - 1466-8033

IS - 11

ER -

ID: 52885094