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Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II)

The title Ni(II) complex, [Ni(C(7)H(4)ClO(2))(2)(C(6)H(6)N(2)O)(2)(H(2)O)(2)], is centrosymmetric with the Ni atom located on an inversion centre. The mol­ecule contains two 2-chloro­benzoate (CB) and two nicotinamide (NA) ligands and two water mol­ecules, all ligands being monodentate. The four O a...

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Autores principales: Hökelek, Tuncer, Dal, Hakan, Tercan, Barış, Özbek, F. Elif, Necefoğlu, Hacali
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968958/
https://www.ncbi.nlm.nih.gov/pubmed/21582397
http://dx.doi.org/10.1107/S1600536809011209
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author Hökelek, Tuncer
Dal, Hakan
Tercan, Barış
Özbek, F. Elif
Necefoğlu, Hacali
author_facet Hökelek, Tuncer
Dal, Hakan
Tercan, Barış
Özbek, F. Elif
Necefoğlu, Hacali
author_sort Hökelek, Tuncer
collection PubMed
description The title Ni(II) complex, [Ni(C(7)H(4)ClO(2))(2)(C(6)H(6)N(2)O)(2)(H(2)O)(2)], is centrosymmetric with the Ni atom located on an inversion centre. The mol­ecule contains two 2-chloro­benzoate (CB) and two nicotinamide (NA) ligands and two water mol­ecules, all ligands being monodentate. The four O atoms in the equatorial plane around the Ni atom form a slightly distorted square-planar arrangement, while the slightly distorted octa­hedral coordination is completed by the two N atoms of the NA ligands in the axial positions. The dihedral angle between the carboxyl group and the adjacent benzene ring is 29.48 (16)°, while the pyridine and benzene rings are oriented at a dihedral angle of 83.16 (5)°. In the crystal structure, O—H⋯O and N—H⋯O hydrogen bonds link the mol­ecules into infinite chains. π–π Contacts between the benzene and pyridine rings [centroid–centroid distance = 3.952 (1) Å] may further stabilize the crystal structure. There is also a C—H⋯π inter­action.
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spelling pubmed-29689582010-12-30 Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II) Hökelek, Tuncer Dal, Hakan Tercan, Barış Özbek, F. Elif Necefoğlu, Hacali Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title Ni(II) complex, [Ni(C(7)H(4)ClO(2))(2)(C(6)H(6)N(2)O)(2)(H(2)O)(2)], is centrosymmetric with the Ni atom located on an inversion centre. The mol­ecule contains two 2-chloro­benzoate (CB) and two nicotinamide (NA) ligands and two water mol­ecules, all ligands being monodentate. The four O atoms in the equatorial plane around the Ni atom form a slightly distorted square-planar arrangement, while the slightly distorted octa­hedral coordination is completed by the two N atoms of the NA ligands in the axial positions. The dihedral angle between the carboxyl group and the adjacent benzene ring is 29.48 (16)°, while the pyridine and benzene rings are oriented at a dihedral angle of 83.16 (5)°. In the crystal structure, O—H⋯O and N—H⋯O hydrogen bonds link the mol­ecules into infinite chains. π–π Contacts between the benzene and pyridine rings [centroid–centroid distance = 3.952 (1) Å] may further stabilize the crystal structure. There is also a C—H⋯π inter­action. International Union of Crystallography 2009-03-31 /pmc/articles/PMC2968958/ /pubmed/21582397 http://dx.doi.org/10.1107/S1600536809011209 Text en © Hökelek et al. 2009 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
Dal, Hakan
Tercan, Barış
Özbek, F. Elif
Necefoğlu, Hacali
Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II)
title Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II)
title_full Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II)
title_fullStr Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II)
title_full_unstemmed Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II)
title_short Diaqua­bis(2-chloro­benzoato-κO)bis­(nicotinamide-κN (1))nickel(II)
title_sort diaqua­bis(2-chloro­benzoato-κo)bis­(nicotinamide-κn (1))nickel(ii)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968958/
https://www.ncbi.nlm.nih.gov/pubmed/21582397
http://dx.doi.org/10.1107/S1600536809011209
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