Neutral heteroleptic complexes of bis(2-halopyridine)dihalocopper(II) family: How the nature of halogen atom affects supramolecular motifs and energies of halogen bonding in solid state?

dc.contributor.author	Usoltsev A.N.
dc.contributor.author	Novikov A.S.
dc.contributor.author	Sokolov M.N.
dc.contributor.author	Adonin S.A.
dc.date.accessioned	2021-02-26T20:38:29Z
dc.date.available	2021-02-26T20:38:29Z
dc.date.issued	2020
dc.identifier.issn	1293-2558
dc.identifier.uri	https://dspace.kpfu.ru/xmlui/handle/net/163059
dc.description.abstract	© 2020 Elsevier Masson SAS Heteroleptic complexes [Cu(2-IPy)2 × 2] (2-IPy = 2-iodopyridine, X = Cl (1), Br (2)) were synthesized and characterized by X-ray diffractometry and thermogravimetric analysis (TGA). Analysis of their structures reveals differences of halogen bonding (XB) patterns with those in previously reported [Cu(2-XPy)2Y2] (X and Y = Cl or Br, respectively). DFT calculations were performed for the whole series, enabling estimation of XB energies.
dc.relation.ispartofseries	Solid State Sciences
dc.subject	Copper
dc.subject	DFT calculations
dc.subject	Halogen bonding
dc.subject	N-donor ligands
dc.subject	Supramolecular contacts
dc.title	Neutral heteroleptic complexes of bis(2-halopyridine)dihalocopper(II) family: How the nature of halogen atom affects supramolecular motifs and energies of halogen bonding in solid state?
dc.type	Article
dc.relation.ispartofseries-volume	109
dc.collection	Публикации сотрудников КФУ
dc.source.id	SCOPUS12932558-2020-109-SID85092541850

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