Research output: Contribution to journal › Article › peer-review
Bis(2,1,3-benzotelluradiazolidyl)2,1,3-benzotelluradiazole : A pair of radical anions coupled by Te⋯N chalcogen bonding. / Puskarevsky, Nikolay A.; Smolentsev, Anton I.; Dmitriev, Alexey A. et al.
In: Chemical Communications, Vol. 56, No. 7, 01.01.2020, p. 1113-1116.Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - Bis(2,1,3-benzotelluradiazolidyl)2,1,3-benzotelluradiazole
T2 - A pair of radical anions coupled by Te⋯N chalcogen bonding
AU - Puskarevsky, Nikolay A.
AU - Smolentsev, Anton I.
AU - Dmitriev, Alexey A.
AU - Vargas-Baca, Ignacio
AU - Gritsan, Nina P.
AU - Beckmann, Jens
AU - Zibarev, Andrey V.
N1 - Publisher Copyright: © 2020 The Royal Society of Chemistry. Copyright: Copyright 2020 Elsevier B.V., All rights reserved.
PY - 2020/1/1
Y1 - 2020/1/1
N2 - Reduction of 2,1,3-benzotelluradiazole (3) yielded a crystalline solid that features a trimeric dianion formally composed of two [3]- and one 3 bridged by unusually asymmetric Te⋯N chalcogen bonds. The solid is diamagnetic due to strong antiferromagnetic coupling, as revealed by CASSCF/CASPT2 and BS-DFT.
AB - Reduction of 2,1,3-benzotelluradiazole (3) yielded a crystalline solid that features a trimeric dianion formally composed of two [3]- and one 3 bridged by unusually asymmetric Te⋯N chalcogen bonds. The solid is diamagnetic due to strong antiferromagnetic coupling, as revealed by CASSCF/CASPT2 and BS-DFT.
KW - 2ND-ORDER PERTURBATION-THEORY
KW - X-RAY-STRUCTURE
KW - SUPRAMOLECULAR ASSOCIATION
KW - ORGANIC RADICALS
KW - COMPLEXES
KW - TELLURIUM
KW - SPECTRA
KW - SYSTEMS
KW - SALTS
KW - TE
UR - http://www.scopus.com/inward/record.url?scp=85078403494&partnerID=8YFLogxK
U2 - 10.1039/c9cc08110k
DO - 10.1039/c9cc08110k
M3 - Article
C2 - 31894772
AN - SCOPUS:85078403494
VL - 56
SP - 1113
EP - 1116
JO - Chemical Communications
JF - Chemical Communications
SN - 1359-7345
IS - 7
ER -
ID: 23258047