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Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2) O:O] dihydrate]
The asymmetric unit of the title one-dimensional polymeric compound, {[Co(C(10)H(11)O(2))(2)(H(2)O)(3)]·2H(2)O}(n), contains one Co(II) cation situated on a centre of inversion, one-half of a coordinating water molecule, one 2,4,6-trimethylbenzoate (TMB) anion together with one coordinating and o...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5418789/ https://www.ncbi.nlm.nih.gov/pubmed/28529781 http://dx.doi.org/10.1107/S2056989017005564 |
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author | Hökelek, Tuncer Akduran, Nurcan Özkaya, Safiye Necefoğlu, Hacali |
author_facet | Hökelek, Tuncer Akduran, Nurcan Özkaya, Safiye Necefoğlu, Hacali |
author_sort | Hökelek, Tuncer |
collection | PubMed |
description | The asymmetric unit of the title one-dimensional polymeric compound, {[Co(C(10)H(11)O(2))(2)(H(2)O)(3)]·2H(2)O}(n), contains one Co(II) cation situated on a centre of inversion, one-half of a coordinating water molecule, one 2,4,6-trimethylbenzoate (TMB) anion together with one coordinating and one non-coordinating water molecule; the TMB anion acts as a monodentate ligand. In the anion, the carboxylate group is twisted away from the attached benzene ring by 84.9 (2)°. The Co(II) atom is coordinated by two TMB anions and two water molecules in the basal plane, while another water molecule bridges the Co(II) atoms in the axial directions, forming polymeric chains running along [001]. The coordination environment for the Co(II) cation is a slightly distorted octahedron. The coordinating and bridging water molecules link to the carboxylate groups via intra- and intermolecular O—H⋯O hydrogen bonds, enclosing S(6) ring motifs, while the coordinating, bridging and non-coordinating water molecules link to the carboxylate groups and the coordinating water molecules link to the non-coordinating water molecules via O—H⋯O hydrogen bonds, enclosing R (2) (2)(8) and R (3) (3)(8) ring motifs. Weak C—H⋯O and C—H⋯π interactions may further stabilize the crystal structure. |
format | Online Article Text |
id | pubmed-5418789 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-54187892017-05-19 Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2) O:O] dihydrate] Hökelek, Tuncer Akduran, Nurcan Özkaya, Safiye Necefoğlu, Hacali Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title one-dimensional polymeric compound, {[Co(C(10)H(11)O(2))(2)(H(2)O)(3)]·2H(2)O}(n), contains one Co(II) cation situated on a centre of inversion, one-half of a coordinating water molecule, one 2,4,6-trimethylbenzoate (TMB) anion together with one coordinating and one non-coordinating water molecule; the TMB anion acts as a monodentate ligand. In the anion, the carboxylate group is twisted away from the attached benzene ring by 84.9 (2)°. The Co(II) atom is coordinated by two TMB anions and two water molecules in the basal plane, while another water molecule bridges the Co(II) atoms in the axial directions, forming polymeric chains running along [001]. The coordination environment for the Co(II) cation is a slightly distorted octahedron. The coordinating and bridging water molecules link to the carboxylate groups via intra- and intermolecular O—H⋯O hydrogen bonds, enclosing S(6) ring motifs, while the coordinating, bridging and non-coordinating water molecules link to the carboxylate groups and the coordinating water molecules link to the non-coordinating water molecules via O—H⋯O hydrogen bonds, enclosing R (2) (2)(8) and R (3) (3)(8) ring motifs. Weak C—H⋯O and C—H⋯π interactions may further stabilize the crystal structure. International Union of Crystallography 2017-04-13 /pmc/articles/PMC5418789/ /pubmed/28529781 http://dx.doi.org/10.1107/S2056989017005564 Text en © Hökelek et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Hökelek, Tuncer Akduran, Nurcan Özkaya, Safiye Necefoğlu, Hacali Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2) O:O] dihydrate] |
title | Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2)
O:O] dihydrate] |
title_full | Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2)
O:O] dihydrate] |
title_fullStr | Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2)
O:O] dihydrate] |
title_full_unstemmed | Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2)
O:O] dihydrate] |
title_short | Crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κO)cobalt(II)]-μ-aqua-κ(2)
O:O] dihydrate] |
title_sort | crystal structure of catena-poly[[[diaquabis(2,4,6-trimethylbenzoato-κo)cobalt(ii)]-μ-aqua-κ(2)
o:o] dihydrate] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5418789/ https://www.ncbi.nlm.nih.gov/pubmed/28529781 http://dx.doi.org/10.1107/S2056989017005564 |
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