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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...

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Autores principales: Hökelek, Tuncer, Akduran, Nurcan, Özkaya, Safiye, Necefoğlu, Hacali
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
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.
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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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