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Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate]
The title coordination polymer, {[Co(2)(C(15)H(7)O(7))(OH)(C(14)H(14)N(4))]·0.25H(2)O}(n), was synthesized under hydrothermal conditions. The asymmetric unit contains two Co(2+) ions, one L (3−) anion originating from 5-(4-carboxyphenoxy)isophthalic acid (H(3) L), one OH(−) ligand, one 1,4-bis[...
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/PMC4257313/ https://www.ncbi.nlm.nih.gov/pubmed/25484783 http://dx.doi.org/10.1107/S1600536814022806 |
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author | Li, Yaping Sun, Dajun Ming, Julia Han, Liying Su, Guanfang |
author_facet | Li, Yaping Sun, Dajun Ming, Julia Han, Liying Su, Guanfang |
author_sort | Li, Yaping |
collection | PubMed |
description | The title coordination polymer, {[Co(2)(C(15)H(7)O(7))(OH)(C(14)H(14)N(4))]·0.25H(2)O}(n), was synthesized under hydrothermal conditions. The asymmetric unit contains two Co(2+) ions, one L (3−) anion originating from 5-(4-carboxyphenoxy)isophthalic acid (H(3) L), one OH(−) ligand, one 1,4-bis[(1H-imidazol-l-yl)methyl]benzene (bix) ligand and one disordered lattice water molecule (occupancy 0.25). The two Co(2+) ions have different environments. One has an octahedral O(4)N(2) coordination sphere, defined by four O atoms from three carboxylate groups and one OH(−) ligand, and two N atoms from two symmetry-related bix ligands. The other has a trigonal-bipyramidal O(5) coordination sphere resulting from three carboxylate groups and two OH(−) ligands. The dihedral angles between the two benzene rings in the L (3−) ligand and between the benzene ring and the two imidazole rings in the bix ligand are 67.05 (15), 75.27 (17) and 82.05 (17)°, respectively. Four neighbouring Co(2+) ions are linked by six carboxylate groups and two μ (3)-OH ligands, forming a butterfly-shaped secondary building unit (SBU). These SBUs are connected by L (3−) anions into layers parallel to (1-10). Adjacent layers are cross-linked by the bix ligands, forming a three-dimensional framework that has a bimodal (3,8)-connected tfz-d topology. The disordered lattice water molecule is located in the voids of the framework and has O⋯O and O⋯N contacts of 2.81 (2) and 2.95 (2) Å, suggesting medium-strength hydrogen bonds. The title compound may be a good candidate for artificial eye lenses. |
format | Online Article Text |
id | pubmed-4257313 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-42573132014-12-05 Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate] Li, Yaping Sun, Dajun Ming, Julia Han, Liying Su, Guanfang Acta Crystallogr Sect E Struct Rep Online Data Reports The title coordination polymer, {[Co(2)(C(15)H(7)O(7))(OH)(C(14)H(14)N(4))]·0.25H(2)O}(n), was synthesized under hydrothermal conditions. The asymmetric unit contains two Co(2+) ions, one L (3−) anion originating from 5-(4-carboxyphenoxy)isophthalic acid (H(3) L), one OH(−) ligand, one 1,4-bis[(1H-imidazol-l-yl)methyl]benzene (bix) ligand and one disordered lattice water molecule (occupancy 0.25). The two Co(2+) ions have different environments. One has an octahedral O(4)N(2) coordination sphere, defined by four O atoms from three carboxylate groups and one OH(−) ligand, and two N atoms from two symmetry-related bix ligands. The other has a trigonal-bipyramidal O(5) coordination sphere resulting from three carboxylate groups and two OH(−) ligands. The dihedral angles between the two benzene rings in the L (3−) ligand and between the benzene ring and the two imidazole rings in the bix ligand are 67.05 (15), 75.27 (17) and 82.05 (17)°, respectively. Four neighbouring Co(2+) ions are linked by six carboxylate groups and two μ (3)-OH ligands, forming a butterfly-shaped secondary building unit (SBU). These SBUs are connected by L (3−) anions into layers parallel to (1-10). Adjacent layers are cross-linked by the bix ligands, forming a three-dimensional framework that has a bimodal (3,8)-connected tfz-d topology. The disordered lattice water molecule is located in the voids of the framework and has O⋯O and O⋯N contacts of 2.81 (2) and 2.95 (2) Å, suggesting medium-strength hydrogen bonds. The title compound may be a good candidate for artificial eye lenses. International Union of Crystallography 2014-10-29 /pmc/articles/PMC4257313/ /pubmed/25484783 http://dx.doi.org/10.1107/S1600536814022806 Text en © Li 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 | Data Reports Li, Yaping Sun, Dajun Ming, Julia Han, Liying Su, Guanfang Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate] |
title | Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate] |
title_full | Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate] |
title_fullStr | Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate] |
title_full_unstemmed | Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate] |
title_short | Crystal structure of poly[[{μ(2)-1,4-bis[(1H-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(II)] 0.25-hydrate] |
title_sort | crystal structure of poly[[{μ(2)-1,4-bis[(1h-imidazol-1-yl)methyl]benzene}[μ(6)-5-(4-carboxylatophenoxy)isophthalato]-μ(3)-hydroxido-dicobalt(ii)] 0.25-hydrate] |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257313/ https://www.ncbi.nlm.nih.gov/pubmed/25484783 http://dx.doi.org/10.1107/S1600536814022806 |
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