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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...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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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. |
format | Online Article Text |
id | pubmed-4158508 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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