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Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)]

The title centrosymmetric bimetallic complex, [Cu(2)(C(2)H(3)O(2))(4)(C(6)H(6)N(2)O)(4)], is composed of two copper(II) cations, four acetate anions and four isonicotinamide (INA) ligands. The asymmetric unit contains one copper cation to which two acetate units bind asymmetrically; one of the Cu—O...

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Autores principales: Perec, Mireille, Baggio, Ricardo
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983640/
https://www.ncbi.nlm.nih.gov/pubmed/21580223
http://dx.doi.org/10.1107/S1600536810004393
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author Perec, Mireille
Baggio, Ricardo
author_facet Perec, Mireille
Baggio, Ricardo
author_sort Perec, Mireille
collection PubMed
description The title centrosymmetric bimetallic complex, [Cu(2)(C(2)H(3)O(2))(4)(C(6)H(6)N(2)O)(4)], is composed of two copper(II) cations, four acetate anions and four isonicotinamide (INA) ligands. The asymmetric unit contains one copper cation to which two acetate units bind asymmetrically; one of the Cu—O distances is rather long [2.740 (2) Å], almost at the limit of coordination. These Cu—O bonds define an equatorial plane to which the Cu—N bonds to the INA ligands are almost perpendicular, the Cu—N vectors subtending angles of 2.4 (1) and 2.3 (1)° to the normal to the plane. The metal coordination geometry can be described as a slightly distorted trigonal bipyramid if the extremely weak Cu—O bond is disregarded, or as a highly distorted square bipyramid if it is not. The double acetate bridge between the copper ions is not coplanar with the CuO(4) equatorial planes, the dihedral angle between the (O—C—O)(2) and O—Cu—O groups being 34.3 (1)°, resulting in a sofa-like conformation for the 8-member bridging loop. In the crystal, N—H⋯O hydrogen bonds occur, some of which generate a head-to tail-linkage between INA units, giving raise to chains along [101]; the remaining ones make inter-chain contacts, defining a three-dimensional network. There are in addition a number of C—H⋯O bonds involving aromatic H atoms. Probably due to steric hindrance, the aromatic rings are not involved in significant π⋯π inter­actions.
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spelling pubmed-29836402010-12-30 Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)] Perec, Mireille Baggio, Ricardo Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title centrosymmetric bimetallic complex, [Cu(2)(C(2)H(3)O(2))(4)(C(6)H(6)N(2)O)(4)], is composed of two copper(II) cations, four acetate anions and four isonicotinamide (INA) ligands. The asymmetric unit contains one copper cation to which two acetate units bind asymmetrically; one of the Cu—O distances is rather long [2.740 (2) Å], almost at the limit of coordination. These Cu—O bonds define an equatorial plane to which the Cu—N bonds to the INA ligands are almost perpendicular, the Cu—N vectors subtending angles of 2.4 (1) and 2.3 (1)° to the normal to the plane. The metal coordination geometry can be described as a slightly distorted trigonal bipyramid if the extremely weak Cu—O bond is disregarded, or as a highly distorted square bipyramid if it is not. The double acetate bridge between the copper ions is not coplanar with the CuO(4) equatorial planes, the dihedral angle between the (O—C—O)(2) and O—Cu—O groups being 34.3 (1)°, resulting in a sofa-like conformation for the 8-member bridging loop. In the crystal, N—H⋯O hydrogen bonds occur, some of which generate a head-to tail-linkage between INA units, giving raise to chains along [101]; the remaining ones make inter-chain contacts, defining a three-dimensional network. There are in addition a number of C—H⋯O bonds involving aromatic H atoms. Probably due to steric hindrance, the aromatic rings are not involved in significant π⋯π inter­actions. International Union of Crystallography 2010-02-10 /pmc/articles/PMC2983640/ /pubmed/21580223 http://dx.doi.org/10.1107/S1600536810004393 Text en © Perec and Baggio 2010 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Metal-Organic Papers
Perec, Mireille
Baggio, Ricardo
Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)]
title Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)]
title_full Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)]
title_fullStr Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)]
title_full_unstemmed Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)]
title_short Di-μ-acetato-bis­[(acetato-κ(2) O,O′)bis­(iso­nicotinamide-κN)copper(II)]
title_sort di-μ-acetato-bis­[(acetato-κ(2) o,o′)bis­(iso­nicotinamide-κn)copper(ii)]
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983640/
https://www.ncbi.nlm.nih.gov/pubmed/21580223
http://dx.doi.org/10.1107/S1600536810004393
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