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Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II)

The title Cu(II) complex, [Cu(C(7)H(4)BrO(2))(2)(C(10)H(14)N(2)O)(2)(H(2)O)(2)], contains two 4-bromo­benzoate (PBB), two diethyl­nicotinamide (DENA) monodentate ligands and two water mol­ecules. The four O atoms in the equatorial plane around the Cu(II) ion form a slightly distorted square-planar a...

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Autores principales: Necefoğlu, Hacali, Özbek, Füreya Elif, Öztürk, Vijdan, Adıgüzel, Vedat, Hökelek, Tuncer
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200662/
https://www.ncbi.nlm.nih.gov/pubmed/22058894
http://dx.doi.org/10.1107/S1600536811034787
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author Necefoğlu, Hacali
Özbek, Füreya Elif
Öztürk, Vijdan
Adıgüzel, Vedat
Hökelek, Tuncer
author_facet Necefoğlu, Hacali
Özbek, Füreya Elif
Öztürk, Vijdan
Adıgüzel, Vedat
Hökelek, Tuncer
author_sort Necefoğlu, Hacali
collection PubMed
description The title Cu(II) complex, [Cu(C(7)H(4)BrO(2))(2)(C(10)H(14)N(2)O)(2)(H(2)O)(2)], contains two 4-bromo­benzoate (PBB), two diethyl­nicotinamide (DENA) monodentate ligands and two water mol­ecules. The four O atoms in the equatorial plane around the Cu(II) ion form a slightly distorted square-planar arrangement, while the slightly distorted octa­hedral coordination is completed by two N atoms of the DENA ligands in the axial positions. Intra­molecular O—H⋯O hydrogen bonds link the water mol­ecules to the carboxyl­ate groups. The dihedral angles between the carboxyl­ate groups and the adjacent benzene rings are 3.1 (3) and 3.74 (17)°, while the pyridine rings and the benzene rings are oriented at dihedral angles of 6.81 (10) and 3.38 (12)°. In the crystal, inter­molecular O—H⋯O hydrogen bonds link the mol­ecules into double chains along the b axis. C—H⋯O inter­actions are also observed. π–π contacts between pyridine rings [centroid–centroid distance = 3.485 (2) Å] may further stabilize the crystal structure.
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spelling pubmed-32006622011-11-06 Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II) Necefoğlu, Hacali Özbek, Füreya Elif Öztürk, Vijdan Adıgüzel, Vedat Hökelek, Tuncer Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title Cu(II) complex, [Cu(C(7)H(4)BrO(2))(2)(C(10)H(14)N(2)O)(2)(H(2)O)(2)], contains two 4-bromo­benzoate (PBB), two diethyl­nicotinamide (DENA) monodentate ligands and two water mol­ecules. The four O atoms in the equatorial plane around the Cu(II) ion form a slightly distorted square-planar arrangement, while the slightly distorted octa­hedral coordination is completed by two N atoms of the DENA ligands in the axial positions. Intra­molecular O—H⋯O hydrogen bonds link the water mol­ecules to the carboxyl­ate groups. The dihedral angles between the carboxyl­ate groups and the adjacent benzene rings are 3.1 (3) and 3.74 (17)°, while the pyridine rings and the benzene rings are oriented at dihedral angles of 6.81 (10) and 3.38 (12)°. In the crystal, inter­molecular O—H⋯O hydrogen bonds link the mol­ecules into double chains along the b axis. C—H⋯O inter­actions are also observed. π–π contacts between pyridine rings [centroid–centroid distance = 3.485 (2) Å] may further stabilize the crystal structure. International Union of Crystallography 2011-08-31 /pmc/articles/PMC3200662/ /pubmed/22058894 http://dx.doi.org/10.1107/S1600536811034787 Text en © Necefoğlu et al. 2011 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
Necefoğlu, Hacali
Özbek, Füreya Elif
Öztürk, Vijdan
Adıgüzel, Vedat
Hökelek, Tuncer
Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II)
title Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II)
title_full Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II)
title_fullStr Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II)
title_full_unstemmed Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II)
title_short Diaqua­bis­(4-bromo­benzoato-κO)bis­(N,N-diethyl­nicotinamide-κN (1))copper(II)
title_sort diaqua­bis­(4-bromo­benzoato-κo)bis­(n,n-diethyl­nicotinamide-κn (1))copper(ii)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3200662/
https://www.ncbi.nlm.nih.gov/pubmed/22058894
http://dx.doi.org/10.1107/S1600536811034787
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