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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...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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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. |
format | Online Article Text |
id | pubmed-3120458 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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