Cargando…
Diaquabis(N,N-diethylnicotinamide-κN (1))bis(4-formylbenzoato-κO (1))zinc
In the title complex, [Zn(C(8)H(5)O(3))(2)(C(10)H(14)N(2)O)(2)(H(2)O)(2)], the Zn(II) cation is located on an inversion center and is coordinated by two 4-formylbenzoate anions, two N,N-diethylnicotinamide (DENA) ligands and two water molecules. The four O atoms in the equatorial plane around the...
Autores principales: | , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414129/ https://www.ncbi.nlm.nih.gov/pubmed/22904736 http://dx.doi.org/10.1107/S1600536812031200 |
_version_ | 1782240157542383616 |
---|---|
author | Sertçelik, Mustafa Çaylak Delibaş, Nagihan Necefoğlu, Hacali Hökelek, Tuncer |
author_facet | Sertçelik, Mustafa Çaylak Delibaş, Nagihan Necefoğlu, Hacali Hökelek, Tuncer |
author_sort | Sertçelik, Mustafa |
collection | PubMed |
description | In the title complex, [Zn(C(8)H(5)O(3))(2)(C(10)H(14)N(2)O)(2)(H(2)O)(2)], the Zn(II) cation is located on an inversion center and is coordinated by two 4-formylbenzoate anions, two N,N-diethylnicotinamide (DENA) ligands and two water molecules. The four O atoms in the equatorial plane around the Zn(II) cation form a slightly distorted square-planar arrangement, while the slightly distorted octahedral coordination is completed by the two N atoms of the DENA ligands in the axial positions. The dihedral angle between the carboxylate group and the adjacent benzene ring is 2.96 (11)°, while the pyridine ring and the benzene ring are oriented at a dihedral angle of 79.26 (4)°. The coordinating water molecule links with the carboxylate group via an intramolecular O—H⋯O hydrogen bond. In the crystal, O—H⋯O and weak C—H⋯O hydrogen bonds link the molecules into a three-dimensional supramolecular network. A π–π contact between the parallel pyridine rings of adjacent molecules may further stabilize the crystal structure [centroid–centroid distance = 3.5654 (8) Å]. |
format | Online Article Text |
id | pubmed-3414129 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-34141292012-08-17 Diaquabis(N,N-diethylnicotinamide-κN (1))bis(4-formylbenzoato-κO (1))zinc Sertçelik, Mustafa Çaylak Delibaş, Nagihan Necefoğlu, Hacali Hökelek, Tuncer Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title complex, [Zn(C(8)H(5)O(3))(2)(C(10)H(14)N(2)O)(2)(H(2)O)(2)], the Zn(II) cation is located on an inversion center and is coordinated by two 4-formylbenzoate anions, two N,N-diethylnicotinamide (DENA) ligands and two water molecules. The four O atoms in the equatorial plane around the Zn(II) cation form a slightly distorted square-planar arrangement, while the slightly distorted octahedral coordination is completed by the two N atoms of the DENA ligands in the axial positions. The dihedral angle between the carboxylate group and the adjacent benzene ring is 2.96 (11)°, while the pyridine ring and the benzene ring are oriented at a dihedral angle of 79.26 (4)°. The coordinating water molecule links with the carboxylate group via an intramolecular O—H⋯O hydrogen bond. In the crystal, O—H⋯O and weak C—H⋯O hydrogen bonds link the molecules into a three-dimensional supramolecular network. A π–π contact between the parallel pyridine rings of adjacent molecules may further stabilize the crystal structure [centroid–centroid distance = 3.5654 (8) Å]. International Union of Crystallography 2012-07-14 /pmc/articles/PMC3414129/ /pubmed/22904736 http://dx.doi.org/10.1107/S1600536812031200 Text en © Sertçelik et al. 2012 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 Sertçelik, Mustafa Çaylak Delibaş, Nagihan Necefoğlu, Hacali Hökelek, Tuncer Diaquabis(N,N-diethylnicotinamide-κN (1))bis(4-formylbenzoato-κO (1))zinc |
title | Diaquabis(N,N-diethylnicotinamide-κN
(1))bis(4-formylbenzoato-κO
(1))zinc |
title_full | Diaquabis(N,N-diethylnicotinamide-κN
(1))bis(4-formylbenzoato-κO
(1))zinc |
title_fullStr | Diaquabis(N,N-diethylnicotinamide-κN
(1))bis(4-formylbenzoato-κO
(1))zinc |
title_full_unstemmed | Diaquabis(N,N-diethylnicotinamide-κN
(1))bis(4-formylbenzoato-κO
(1))zinc |
title_short | Diaquabis(N,N-diethylnicotinamide-κN
(1))bis(4-formylbenzoato-κO
(1))zinc |
title_sort | diaquabis(n,n-diethylnicotinamide-κn
(1))bis(4-formylbenzoato-κo
(1))zinc |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414129/ https://www.ncbi.nlm.nih.gov/pubmed/22904736 http://dx.doi.org/10.1107/S1600536812031200 |
work_keys_str_mv | AT sertcelikmustafa diaquabisnndiethylnicotinamidekn1bis4formylbenzoatoko1zinc AT caylakdelibasnagihan diaquabisnndiethylnicotinamidekn1bis4formylbenzoatoko1zinc AT necefogluhacali diaquabisnndiethylnicotinamidekn1bis4formylbenzoatoko1zinc AT hokelektuncer diaquabisnndiethylnicotinamidekn1bis4formylbenzoatoko1zinc |