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Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]

The polymeric title compound, {[Ba(2)(C(9)H(4)N(2)O(4))(2)(H(2)O)]·4.5H(2)O}(n), adopts a layer structure parallel to (001) in which adjacent Ba(II) atoms are connected by two benzimidazole-5,6-dicarboxyl­ate dianions, one functioning in a μ(4)-bridging mode and the other in a μ(5)-bridging mode. Th...

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Autores principales: Zhang, Heng-Qiang, Zheng, Xiu-Jun, Zhao, Chun-Xiang, Ng, Seik Weng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120458/
https://www.ncbi.nlm.nih.gov/pubmed/21754581
http://dx.doi.org/10.1107/S160053681101590X
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author Zhang, Heng-Qiang
Zheng, Xiu-Jun
Zhao, Chun-Xiang
Ng, Seik Weng
author_facet Zhang, Heng-Qiang
Zheng, Xiu-Jun
Zhao, Chun-Xiang
Ng, Seik Weng
author_sort Zhang, Heng-Qiang
collection PubMed
description The polymeric title compound, {[Ba(2)(C(9)H(4)N(2)O(4))(2)(H(2)O)]·4.5H(2)O}(n), adopts a layer structure parallel to (001) in which adjacent Ba(II) atoms are connected by two benzimidazole-5,6-dicarboxyl­ate dianions, one functioning in a μ(4)-bridging mode and the other in a μ(5)-bridging mode. The Ba atom having water in its coordination environment as well as the Ba atom without water exist in a nine-coordinate polyhedron of O atoms; the geometry is difficult to derive. Lattice water mol­ecules occupy the space between layers and inter­act with the layers through O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds. ne of the five lattice water molecules is equally disordered around an inversion centre and shows half-occupancy.
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spelling pubmed-31204582011-07-13 Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate] Zhang, Heng-Qiang Zheng, Xiu-Jun Zhao, Chun-Xiang Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The polymeric title compound, {[Ba(2)(C(9)H(4)N(2)O(4))(2)(H(2)O)]·4.5H(2)O}(n), adopts a layer structure parallel to (001) in which adjacent Ba(II) atoms are connected by two benzimidazole-5,6-dicarboxyl­ate dianions, one functioning in a μ(4)-bridging mode and the other in a μ(5)-bridging mode. The Ba atom having water in its coordination environment as well as the Ba atom without water exist in a nine-coordinate polyhedron of O atoms; the geometry is difficult to derive. Lattice water mol­ecules occupy the space between layers and inter­act with the layers through O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds. ne of the five lattice water molecules is equally disordered around an inversion centre and shows half-occupancy. International Union of Crystallography 2011-05-07 /pmc/articles/PMC3120458/ /pubmed/21754581 http://dx.doi.org/10.1107/S160053681101590X Text en © Zhang et al. 2011 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
Zhang, Heng-Qiang
Zheng, Xiu-Jun
Zhao, Chun-Xiang
Ng, Seik Weng
Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]
title Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]
title_full Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]
title_fullStr Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]
title_full_unstemmed Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]
title_short Poly[[aqua­(μ(5)-1H-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1H-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]
title_sort poly[[aqua­(μ(5)-1h-benzimidazole-5,6-dicarboxyl­ato)(μ(4)-1h-benzimidazole-5,6-dicarboxyl­ato)dibarium] 4.5-hydrate]
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3120458/
https://www.ncbi.nlm.nih.gov/pubmed/21754581
http://dx.doi.org/10.1107/S160053681101590X
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