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Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate]

The asymmetric unit of the title compound, {[CaPd{CH(3)OHC(PO(3))(2)}(H(2)O)(5)]·5/3H(2)O}(n), consists of one half of the complex [Pd{CH(3)OHC(PO(3))(2)}](2−) anion (point group symmetry m..), one Ca(2+) cation [site symmetry (.2.)] that is surrounded by three water mol­ecules (one of which is on t...

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Autores principales: Kutsenko, Irina P., Kozachkova, Alexandra N., Tsaryk, Natalia V., Pekhnyo, Vasily I., Rusanova, Julia A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4158508/
https://www.ncbi.nlm.nih.gov/pubmed/25249877
http://dx.doi.org/10.1107/S1600536814015189
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author Kutsenko, Irina P.
Kozachkova, Alexandra N.
Tsaryk, Natalia V.
Pekhnyo, Vasily I.
Rusanova, Julia A.
author_facet Kutsenko, Irina P.
Kozachkova, Alexandra N.
Tsaryk, Natalia V.
Pekhnyo, Vasily I.
Rusanova, Julia A.
author_sort Kutsenko, Irina P.
collection PubMed
description The asymmetric unit of the title compound, {[CaPd{CH(3)OHC(PO(3))(2)}(H(2)O)(5)]·5/3H(2)O}(n), consists of one half of the complex [Pd{CH(3)OHC(PO(3))(2)}](2−) anion (point group symmetry m..), one Ca(2+) cation [site symmetry (.2.)] that is surrounded by three water mol­ecules (one of which is on the same rotation axis) and by three disordered lattice water mol­ecules. The anions form a trinuclear metallocycle around a crystallographic threefold rotation axis. The cations are related by a twofold rotation axis to form a [Ca(2)(H(2)O)(10)](2+) dimer. The slightly distorted square-planar coordination environment of the Pd(II) atoms in the complex anions is formed by O atoms of the bidentate chelating phospho­nate groups of the 1-hy­droxy­ethyl­idene-1,1-di­phospho­nate ligands. In the crystal, cations are bound to anions through —Ca—O—P—O— bonds, as well as through O—H⋯O hydrogen bonds, resulting in a three-dimensional polymer. The structure is completed by five disordered solvent mol­ecules localized in cavities within the framework.
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spelling pubmed-41585082014-09-23 Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate] Kutsenko, Irina P. Kozachkova, Alexandra N. Tsaryk, Natalia V. Pekhnyo, Vasily I. Rusanova, Julia A. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title compound, {[CaPd{CH(3)OHC(PO(3))(2)}(H(2)O)(5)]·5/3H(2)O}(n), consists of one half of the complex [Pd{CH(3)OHC(PO(3))(2)}](2−) anion (point group symmetry m..), one Ca(2+) cation [site symmetry (.2.)] that is surrounded by three water mol­ecules (one of which is on the same rotation axis) and by three disordered lattice water mol­ecules. The anions form a trinuclear metallocycle around a crystallographic threefold rotation axis. The cations are related by a twofold rotation axis to form a [Ca(2)(H(2)O)(10)](2+) dimer. The slightly distorted square-planar coordination environment of the Pd(II) atoms in the complex anions is formed by O atoms of the bidentate chelating phospho­nate groups of the 1-hy­droxy­ethyl­idene-1,1-di­phospho­nate ligands. In the crystal, cations are bound to anions through —Ca—O—P—O— bonds, as well as through O—H⋯O hydrogen bonds, resulting in a three-dimensional polymer. The structure is completed by five disordered solvent mol­ecules localized in cavities within the framework. International Union of Crystallography 2014-07-05 /pmc/articles/PMC4158508/ /pubmed/25249877 http://dx.doi.org/10.1107/S1600536814015189 Text en © Kutsenko et al. 2014 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
Kutsenko, Irina P.
Kozachkova, Alexandra N.
Tsaryk, Natalia V.
Pekhnyo, Vasily I.
Rusanova, Julia A.
Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate]
title Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate]
title_full Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate]
title_fullStr Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate]
title_full_unstemmed Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate]
title_short Poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(II)tripalladium(II)] penta­hydrate]
title_sort poly[[tri-μ-aqua-do­deca­aqua­tris­(μ(3)-1-hy­droxy­ethyl­idene-1,1-di­phospho­nato)tricalcium(ii)tripalladium(ii)] penta­hydrate]
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4158508/
https://www.ncbi.nlm.nih.gov/pubmed/25249877
http://dx.doi.org/10.1107/S1600536814015189
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