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cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II)

In the title compound, [CuCl(2)(C(4)H(4)N(2)O)(H(2)O)], the Cu(II) cation is coordinated by two chloride anions, one pyrimidin-2-one N atom and one water mol­ecule, giving a slightly distorted square-planar geometry. In the crystal structure, the pyrimidin-2-one rings stack along the b axis, with an...

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Detalles Bibliográficos
Autores principales: Kurawa, Mukhtar A., Adams, Christopher J., Orpen, A. Guy
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961748/
https://www.ncbi.nlm.nih.gov/pubmed/21202815
http://dx.doi.org/10.1107/S1600536808018771
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author Kurawa, Mukhtar A.
Adams, Christopher J.
Orpen, A. Guy
author_facet Kurawa, Mukhtar A.
Adams, Christopher J.
Orpen, A. Guy
author_sort Kurawa, Mukhtar A.
collection PubMed
description In the title compound, [CuCl(2)(C(4)H(4)N(2)O)(H(2)O)], the Cu(II) cation is coordinated by two chloride anions, one pyrimidin-2-one N atom and one water mol­ecule, giving a slightly distorted square-planar geometry. In the crystal structure, the pyrimidin-2-one rings stack along the b axis, with an inter­planar distance of 3.306 Å, as do the copper coordination planes (inter­planar spacing = 2.998 Å). The coordination around the Jahn–Teller-distorted Cu(II) ion is completed by long Cu⋯O [3.014 (5) Å] and Cu⋯Cl [3.0194 (15) Å] inter­actions with adjacent mol­ecules involved in this stacking. Several N—H⋯Cl, O—H⋯Cl and O—H⋯O inter­molecular hydrogen bonds form a polar three-dimensional network.
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spelling pubmed-29617482010-12-30 cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II) Kurawa, Mukhtar A. Adams, Christopher J. Orpen, A. Guy Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, [CuCl(2)(C(4)H(4)N(2)O)(H(2)O)], the Cu(II) cation is coordinated by two chloride anions, one pyrimidin-2-one N atom and one water mol­ecule, giving a slightly distorted square-planar geometry. In the crystal structure, the pyrimidin-2-one rings stack along the b axis, with an inter­planar distance of 3.306 Å, as do the copper coordination planes (inter­planar spacing = 2.998 Å). The coordination around the Jahn–Teller-distorted Cu(II) ion is completed by long Cu⋯O [3.014 (5) Å] and Cu⋯Cl [3.0194 (15) Å] inter­actions with adjacent mol­ecules involved in this stacking. Several N—H⋯Cl, O—H⋯Cl and O—H⋯O inter­molecular hydrogen bonds form a polar three-dimensional network. International Union of Crystallography 2008-06-28 /pmc/articles/PMC2961748/ /pubmed/21202815 http://dx.doi.org/10.1107/S1600536808018771 Text en © Kurawa et al. 2008 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
Kurawa, Mukhtar A.
Adams, Christopher J.
Orpen, A. Guy
cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II)
title cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II)
title_full cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II)
title_fullStr cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II)
title_full_unstemmed cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II)
title_short cis-Aqua­dichlorido[pyrimidin-2(1H)-one-κN (3)]copper(II)
title_sort cis-aqua­dichlorido[pyrimidin-2(1h)-one-κn (3)]copper(ii)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961748/
https://www.ncbi.nlm.nih.gov/pubmed/21202815
http://dx.doi.org/10.1107/S1600536808018771
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