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Crystal structure of bis(μ-3-nitrobenzoato)-κ(3) O,O′:O;κ(3) O:O,O′-bis[bis(3-cyanopyridine-κN (1))(3-nitrobenzoato-κ(2) O,O′)cadmium]
The asymmetric unit of the title compound, [Cd(2)(C(7)H(4)NO(4))(4)(C(6)H(4)N(2))(4)], contains one Cd(II) atom, two 3-nitrobenzoate (NB) anions and two 3-cyanopyridine (CPy) ligands. The two CPy ligands act as monodentate N(pyridine)-bonding ligands, while the two NB anions act as bidentate ligan...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5347067/ https://www.ncbi.nlm.nih.gov/pubmed/28316822 http://dx.doi.org/10.1107/S2056989017002675 |
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author | Hökelek, Tuncer Akduran, Nurcan Özen, Azer Uğurlu, Güventürk Necefoğlu, Hacali |
author_facet | Hökelek, Tuncer Akduran, Nurcan Özen, Azer Uğurlu, Güventürk Necefoğlu, Hacali |
author_sort | Hökelek, Tuncer |
collection | PubMed |
description | The asymmetric unit of the title compound, [Cd(2)(C(7)H(4)NO(4))(4)(C(6)H(4)N(2))(4)], contains one Cd(II) atom, two 3-nitrobenzoate (NB) anions and two 3-cyanopyridine (CPy) ligands. The two CPy ligands act as monodentate N(pyridine)-bonding ligands, while the two NB anions act as bidentate ligands through the carboxylate O atoms. The centrosymmetric dinuclear complex is generated by application of inversion symmetry, whereby the Cd(II) atoms are bridged by the carboxylate O atoms of two symmetry-related NB anions, thus completing the distorted N(2)O(5) pentagonal–bipyramidal coordination sphere of each Cd(II) atom. The benzene and pyridine rings are oriented at dihedral angles of 10.02 (7) and 5.76 (9)°, respectively. In the crystal, C—H⋯N hydrogen bonds link the molecules, enclosing R (2) (2)(26) ring motifs, in which they are further linked via C—H⋯O hydrogen bonds, resulting in a three-dimensional network. In addition, π–π stacking interactions between parallel benzene rings and between parallel pyridine rings of adjacent molecules [shortest centroid-to-centroid distances = 3.885 (1) and 3.712 (1) Å, respectively], as well as a weak C—H⋯π interaction, may further stabilize the crystal structure. |
format | Online Article Text |
id | pubmed-5347067 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-53470672017-03-17 Crystal structure of bis(μ-3-nitrobenzoato)-κ(3) O,O′:O;κ(3) O:O,O′-bis[bis(3-cyanopyridine-κN (1))(3-nitrobenzoato-κ(2) O,O′)cadmium] Hökelek, Tuncer Akduran, Nurcan Özen, Azer Uğurlu, Güventürk Necefoğlu, Hacali Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, [Cd(2)(C(7)H(4)NO(4))(4)(C(6)H(4)N(2))(4)], contains one Cd(II) atom, two 3-nitrobenzoate (NB) anions and two 3-cyanopyridine (CPy) ligands. The two CPy ligands act as monodentate N(pyridine)-bonding ligands, while the two NB anions act as bidentate ligands through the carboxylate O atoms. The centrosymmetric dinuclear complex is generated by application of inversion symmetry, whereby the Cd(II) atoms are bridged by the carboxylate O atoms of two symmetry-related NB anions, thus completing the distorted N(2)O(5) pentagonal–bipyramidal coordination sphere of each Cd(II) atom. The benzene and pyridine rings are oriented at dihedral angles of 10.02 (7) and 5.76 (9)°, respectively. In the crystal, C—H⋯N hydrogen bonds link the molecules, enclosing R (2) (2)(26) ring motifs, in which they are further linked via C—H⋯O hydrogen bonds, resulting in a three-dimensional network. In addition, π–π stacking interactions between parallel benzene rings and between parallel pyridine rings of adjacent molecules [shortest centroid-to-centroid distances = 3.885 (1) and 3.712 (1) Å, respectively], as well as a weak C—H⋯π interaction, may further stabilize the crystal structure. International Union of Crystallography 2017-02-21 /pmc/articles/PMC5347067/ /pubmed/28316822 http://dx.doi.org/10.1107/S2056989017002675 Text en © Hökelek et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Hökelek, Tuncer Akduran, Nurcan Özen, Azer Uğurlu, Güventürk Necefoğlu, Hacali Crystal structure of bis(μ-3-nitrobenzoato)-κ(3) O,O′:O;κ(3) O:O,O′-bis[bis(3-cyanopyridine-κN (1))(3-nitrobenzoato-κ(2) O,O′)cadmium] |
title | Crystal structure of bis(μ-3-nitrobenzoato)-κ(3)
O,O′:O;κ(3)
O:O,O′-bis[bis(3-cyanopyridine-κN
(1))(3-nitrobenzoato-κ(2)
O,O′)cadmium] |
title_full | Crystal structure of bis(μ-3-nitrobenzoato)-κ(3)
O,O′:O;κ(3)
O:O,O′-bis[bis(3-cyanopyridine-κN
(1))(3-nitrobenzoato-κ(2)
O,O′)cadmium] |
title_fullStr | Crystal structure of bis(μ-3-nitrobenzoato)-κ(3)
O,O′:O;κ(3)
O:O,O′-bis[bis(3-cyanopyridine-κN
(1))(3-nitrobenzoato-κ(2)
O,O′)cadmium] |
title_full_unstemmed | Crystal structure of bis(μ-3-nitrobenzoato)-κ(3)
O,O′:O;κ(3)
O:O,O′-bis[bis(3-cyanopyridine-κN
(1))(3-nitrobenzoato-κ(2)
O,O′)cadmium] |
title_short | Crystal structure of bis(μ-3-nitrobenzoato)-κ(3)
O,O′:O;κ(3)
O:O,O′-bis[bis(3-cyanopyridine-κN
(1))(3-nitrobenzoato-κ(2)
O,O′)cadmium] |
title_sort | crystal structure of bis(μ-3-nitrobenzoato)-κ(3)
o,o′:o;κ(3)
o:o,o′-bis[bis(3-cyanopyridine-κn
(1))(3-nitrobenzoato-κ(2)
o,o′)cadmium] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5347067/ https://www.ncbi.nlm.nih.gov/pubmed/28316822 http://dx.doi.org/10.1107/S2056989017002675 |
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