New structural type in polybromide-bromometalate hybrids: (Me3NH)3{[Bi2Br9](Br2)} - Crystal structure and theoretical studies of non-covalent Br •Br interactions

被引：6
|
作者：
Gorokh, Igor D. [1 ,2 ]
Adonin, Sergey A. [1 ,3 ]
Abramov, Pavel A. [1 ,3 ]
Novikov, Alexander S. [4 ]
Sokolov, Maxim N. [1 ,5 ]
Fedin, Vladimir P. [1 ,3 ]
机构：
[1] RAS, Nikolaev Inst Inorgan Chem SB, 3 Lavrentiev Av, Novosibirsk 630090, Russia
[2] Skolkovo Inst Sci & Technol, Ctr Electrochem Energy Storage, Nobel St 3, Moscow 143026, Russia
[3] Novosibirsk State Univ, Pirogova St 2, Novosibirsk 630090, Russia
[4] St Petersburg State Univ, Inst Chem, Univ Skaya Nab 7-9, St Petersburg 199034, Russia
[5] Kazan Fed Univ, Alexander Butlerov Inst Chem, Lobachevskogo St 1-29, Kazan 420008, Russia
来源：
INORGANIC CHEMISTRY COMMUNICATIONS | 2018年 / 98卷
基金：
俄罗斯科学基金会;
关键词：
Polybromides; QTAIM; Bismuth; Halogen bonding; Supramolecular contacts; LIQUID-BASED SYNTHESIS; HYDROGEN; BROMINE; COMPLEXES; CHEMISTRY; NETWORKS; ANIONS;
D O I：
10.1016/j.inoche.2018.10.027
中图分类号：
O61 [无机化学];
学科分类号：
070301 ; 081704 ;
摘要：
Reaction between [BiBr6](3-) and Br-2 in HBr in presence of trimethylammonium bromide results in self-assembly of a supramolecular halometalate-polybromide derivative (Me3NH)(3){[Bi2Br9](Br-2)} belonging to a novel structural type. DFT calculations allowed estimation of Br center dot center dot center dot Br contact energies (1.3-4.4 kcal/mol).
引用
收藏
页码：169 / 173
页数：5
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