Journal
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
Volume -, Issue 42, Pages 4925-4929Publisher
WILEY-V C H VERLAG GMBH
DOI: 10.1002/ejic.201700908
Keywords
Polyhalides; Halogens; QTAIM; Density functional calculations; Halometalates
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Funding
- Russian Science Foundation [14-23-00013]
- Russian Foundation for Basic Research [16-33-60063]
- Russian Federation
- Russian Science Foundation [17-23-00006] Funding Source: Russian Science Foundation
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Reactions between BiCl3, Br-2, and chlorides of pyridinium (1), 4,4-propylenedipyridinium (2), or trimethylphenylammonium (3) in aqueous HCl lead to the formation of chlorobismuthate complexes trapping {Br-2} in the solid state into two-dimensional polyhalide supramolecular networks. The nature of non-covalent BrCl interactions was studied by theoretical methods; estimated energies of these interactions are 1.9-6.0 kcal/mol.
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