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The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex

A copper(II) dimer with the deprotonated anion of 2-bromo­nicotinic acid (2-BrnicH), namely, tetrakis(μ-2-bromonicotinato-κ(2) O:O′)bis[aquacopper(­II)](Cu—Cu), [Cu(2)(H(2)O)(2)(C(6)H(3)BrNO(2))(4)] or [Cu(2)(H(2)O)(2)(2-Brnic)(4)], (1), was prepared by the reaction of copper(II) chloride dihydrate...

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Autores principales: Politeo, Nives, Pisačić, Mateja, Đaković, Marijana, Sokol, Vesna, Kukovec, Boris-Marko
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7001845/
https://www.ncbi.nlm.nih.gov/pubmed/32071751
http://dx.doi.org/10.1107/S2056989020000390
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author Politeo, Nives
Pisačić, Mateja
Đaković, Marijana
Sokol, Vesna
Kukovec, Boris-Marko
author_facet Politeo, Nives
Pisačić, Mateja
Đaković, Marijana
Sokol, Vesna
Kukovec, Boris-Marko
author_sort Politeo, Nives
collection PubMed
description A copper(II) dimer with the deprotonated anion of 2-bromo­nicotinic acid (2-BrnicH), namely, tetrakis(μ-2-bromonicotinato-κ(2) O:O′)bis[aquacopper(­II)](Cu—Cu), [Cu(2)(H(2)O)(2)(C(6)H(3)BrNO(2))(4)] or [Cu(2)(H(2)O)(2)(2-Brnic)(4)], (1), was prepared by the reaction of copper(II) chloride dihydrate and 2-bromo­nicotinic acid in water. The copper(II) ion in 1 has a distorted square-pyramidal coordination environment, achieved by four carboxyl­ate O atoms in the basal plane and the water mol­ecule in the apical position. The pair of symmetry-related copper(II) ions are connected into a centrosymmetric paddle-wheel dinuclear cluster [Cu⋯Cu = 2.6470 (11) Å] via four O,O′-bridging 2-bromo­nicotinate ligands in the syn-syn coordination mode. In the extended structure of 1, the cluster mol­ecules are assembled into an infinite two-dimensional hydrogen-bonded network lying parallel to the (001) plane via strong O—H⋯O and O—H⋯N hydrogen bonds, leading to the formation of various hydrogen-bond ring motifs: dimeric R (2) (2)(8) and R (2) (2)(16) loops and a tetra­meric R (4) (4)(16) loop. The Hirshfeld surface analysis was also performed in order to better illustrate the nature and abundance of the inter­molecular contacts in the structure of 1.
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spelling pubmed-70018452020-02-18 The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex Politeo, Nives Pisačić, Mateja Đaković, Marijana Sokol, Vesna Kukovec, Boris-Marko Acta Crystallogr E Crystallogr Commun Research Communications A copper(II) dimer with the deprotonated anion of 2-bromo­nicotinic acid (2-BrnicH), namely, tetrakis(μ-2-bromonicotinato-κ(2) O:O′)bis[aquacopper(­II)](Cu—Cu), [Cu(2)(H(2)O)(2)(C(6)H(3)BrNO(2))(4)] or [Cu(2)(H(2)O)(2)(2-Brnic)(4)], (1), was prepared by the reaction of copper(II) chloride dihydrate and 2-bromo­nicotinic acid in water. The copper(II) ion in 1 has a distorted square-pyramidal coordination environment, achieved by four carboxyl­ate O atoms in the basal plane and the water mol­ecule in the apical position. The pair of symmetry-related copper(II) ions are connected into a centrosymmetric paddle-wheel dinuclear cluster [Cu⋯Cu = 2.6470 (11) Å] via four O,O′-bridging 2-bromo­nicotinate ligands in the syn-syn coordination mode. In the extended structure of 1, the cluster mol­ecules are assembled into an infinite two-dimensional hydrogen-bonded network lying parallel to the (001) plane via strong O—H⋯O and O—H⋯N hydrogen bonds, leading to the formation of various hydrogen-bond ring motifs: dimeric R (2) (2)(8) and R (2) (2)(16) loops and a tetra­meric R (4) (4)(16) loop. The Hirshfeld surface analysis was also performed in order to better illustrate the nature and abundance of the inter­molecular contacts in the structure of 1. International Union of Crystallography 2020-01-17 /pmc/articles/PMC7001845/ /pubmed/32071751 http://dx.doi.org/10.1107/S2056989020000390 Text en © Politeo et al. 2020 http://creativecommons.org/licenses/by/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/4.0/
spellingShingle Research Communications
Politeo, Nives
Pisačić, Mateja
Đaković, Marijana
Sokol, Vesna
Kukovec, Boris-Marko
The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex
title The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex
title_full The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex
title_fullStr The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex
title_full_unstemmed The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex
title_short The first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(II) complex
title_sort first coordination compound of deprotonated 2-bromo­nicotinic acid: crystal structure of a dinuclear paddle-wheel copper(ii) complex
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7001845/
https://www.ncbi.nlm.nih.gov/pubmed/32071751
http://dx.doi.org/10.1107/S2056989020000390
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