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Bis(isonicotinamide-κN (1))bis(4-methylbenzoato-κO)copper(II) dihydrate
In the centrosymmetric title compound, [Cu(C(8)H(7)O(2))(2)(C(6)H(6)N(2)O)(2)]·2H(2)O, the Cu(II) ion is located on a crystallographic inversion center. The asymmetric unit is completed by one 4-methylbenzoate anion, one isonicotinamide (INA) ligand and one uncoordinated water molecule; all the li...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007312/ https://www.ncbi.nlm.nih.gov/pubmed/21588184 http://dx.doi.org/10.1107/S1600536810028060 |
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author | Hökelek, Tuncer Saka, Güner Tercan, Barış Çimen, Efdal Necefoğlu, Hacali |
author_facet | Hökelek, Tuncer Saka, Güner Tercan, Barış Çimen, Efdal Necefoğlu, Hacali |
author_sort | Hökelek, Tuncer |
collection | PubMed |
description | In the centrosymmetric title compound, [Cu(C(8)H(7)O(2))(2)(C(6)H(6)N(2)O)(2)]·2H(2)O, the Cu(II) ion is located on a crystallographic inversion center. The asymmetric unit is completed by one 4-methylbenzoate anion, one isonicotinamide (INA) ligand and one uncoordinated water molecule; all the ligands are monodentate. The two O and the two N atoms around the Cu(II) ion form a slightly distorted square-planar arrangement. The dihedral angle between the carboxylate group and the attached benzene ring is 13.86 (9)°, while the pyridine and benzene rings are oriented at a dihedral angle of 86.08 (5)°. The uncoordinated water molecules are linked to the INA ligands by O—H⋯O hydrogen bonds. In the crystal structure, intermolecular O—H⋯O, N—H⋯O and C—H⋯O hydrogen bonds link the molecules into a three-dimensional network. |
format | Text |
id | pubmed-3007312 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30073122010-12-30 Bis(isonicotinamide-κN (1))bis(4-methylbenzoato-κO)copper(II) dihydrate Hökelek, Tuncer Saka, Güner Tercan, Barış Çimen, Efdal Necefoğlu, Hacali Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the centrosymmetric title compound, [Cu(C(8)H(7)O(2))(2)(C(6)H(6)N(2)O)(2)]·2H(2)O, the Cu(II) ion is located on a crystallographic inversion center. The asymmetric unit is completed by one 4-methylbenzoate anion, one isonicotinamide (INA) ligand and one uncoordinated water molecule; all the ligands are monodentate. The two O and the two N atoms around the Cu(II) ion form a slightly distorted square-planar arrangement. The dihedral angle between the carboxylate group and the attached benzene ring is 13.86 (9)°, while the pyridine and benzene rings are oriented at a dihedral angle of 86.08 (5)°. The uncoordinated water molecules are linked to the INA ligands by O—H⋯O hydrogen bonds. In the crystal structure, intermolecular O—H⋯O, N—H⋯O and C—H⋯O hydrogen bonds link the molecules into a three-dimensional network. International Union of Crystallography 2010-07-17 /pmc/articles/PMC3007312/ /pubmed/21588184 http://dx.doi.org/10.1107/S1600536810028060 Text en © Hökelek et al. 2010 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 Hökelek, Tuncer Saka, Güner Tercan, Barış Çimen, Efdal Necefoğlu, Hacali Bis(isonicotinamide-κN (1))bis(4-methylbenzoato-κO)copper(II) dihydrate |
title | Bis(isonicotinamide-κN
(1))bis(4-methylbenzoato-κO)copper(II) dihydrate |
title_full | Bis(isonicotinamide-κN
(1))bis(4-methylbenzoato-κO)copper(II) dihydrate |
title_fullStr | Bis(isonicotinamide-κN
(1))bis(4-methylbenzoato-κO)copper(II) dihydrate |
title_full_unstemmed | Bis(isonicotinamide-κN
(1))bis(4-methylbenzoato-κO)copper(II) dihydrate |
title_short | Bis(isonicotinamide-κN
(1))bis(4-methylbenzoato-κO)copper(II) dihydrate |
title_sort | bis(isonicotinamide-κn
(1))bis(4-methylbenzoato-κo)copper(ii) dihydrate |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007312/ https://www.ncbi.nlm.nih.gov/pubmed/21588184 http://dx.doi.org/10.1107/S1600536810028060 |
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