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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...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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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. |
format | Online Article Text |
id | pubmed-3200662 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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