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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...

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Autores principales: Hökelek, Tuncer, Saka, Güner, Tercan, Barış, Çimen, Efdal, Necefoğlu, Hacali
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
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.
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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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