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Bis(1H-imidazole-κN (3))bis(2-oxidopyridinium-3-carboxylato-κ(2) O (2),O (3))nickel(II)
In the crystal structure of the title Ni(II) complex, [Ni(C(6)H(4)NO(3))(2)(C(3)H(4)N(2))(2)], the Ni(II) atom is located on a twofold rotation axis and is chelated by two oxidopyridiniumcarboxylate anions and further cis-coordinated by two imidazole ligands in a distorted cis-N(2)O(4) octahedral...
Autores principales: | , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977237/ https://www.ncbi.nlm.nih.gov/pubmed/21583420 http://dx.doi.org/10.1107/S1600536809028347 |
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author | Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun |
author_facet | Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun |
author_sort | Zhang, Bing-Yu |
collection | PubMed |
description | In the crystal structure of the title Ni(II) complex, [Ni(C(6)H(4)NO(3))(2)(C(3)H(4)N(2))(2)], the Ni(II) atom is located on a twofold rotation axis and is chelated by two oxidopyridiniumcarboxylate anions and further cis-coordinated by two imidazole ligands in a distorted cis-N(2)O(4) octahedral geometry. The C—O bond distance of 1.2573 (19) Å found for the non-coordinating O atom of the carboxylate group indicates significant delocalization of π-electron density over this residue. Similarly, the C—O bond distance of 1.260 (2) Å in the heteroaromatic ring indicates delocalization between the deprotonated hydroxy group and the pyridinium ring. The uncoordinated carboxylate O atom links with the imidazole and pyridinium rings of adjacent molecules via N—H⋯O and C—H⋯O hydrogen bonding, leading to a two-dimensional array parallel to (100). |
format | Text |
id | pubmed-2977237 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29772372010-12-30 Bis(1H-imidazole-κN (3))bis(2-oxidopyridinium-3-carboxylato-κ(2) O (2),O (3))nickel(II) Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the crystal structure of the title Ni(II) complex, [Ni(C(6)H(4)NO(3))(2)(C(3)H(4)N(2))(2)], the Ni(II) atom is located on a twofold rotation axis and is chelated by two oxidopyridiniumcarboxylate anions and further cis-coordinated by two imidazole ligands in a distorted cis-N(2)O(4) octahedral geometry. The C—O bond distance of 1.2573 (19) Å found for the non-coordinating O atom of the carboxylate group indicates significant delocalization of π-electron density over this residue. Similarly, the C—O bond distance of 1.260 (2) Å in the heteroaromatic ring indicates delocalization between the deprotonated hydroxy group and the pyridinium ring. The uncoordinated carboxylate O atom links with the imidazole and pyridinium rings of adjacent molecules via N—H⋯O and C—H⋯O hydrogen bonding, leading to a two-dimensional array parallel to (100). International Union of Crystallography 2009-07-22 /pmc/articles/PMC2977237/ /pubmed/21583420 http://dx.doi.org/10.1107/S1600536809028347 Text en © Zhang 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 Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun Bis(1H-imidazole-κN (3))bis(2-oxidopyridinium-3-carboxylato-κ(2) O (2),O (3))nickel(II) |
title | Bis(1H-imidazole-κN
(3))bis(2-oxidopyridinium-3-carboxylato-κ(2)
O
(2),O
(3))nickel(II) |
title_full | Bis(1H-imidazole-κN
(3))bis(2-oxidopyridinium-3-carboxylato-κ(2)
O
(2),O
(3))nickel(II) |
title_fullStr | Bis(1H-imidazole-κN
(3))bis(2-oxidopyridinium-3-carboxylato-κ(2)
O
(2),O
(3))nickel(II) |
title_full_unstemmed | Bis(1H-imidazole-κN
(3))bis(2-oxidopyridinium-3-carboxylato-κ(2)
O
(2),O
(3))nickel(II) |
title_short | Bis(1H-imidazole-κN
(3))bis(2-oxidopyridinium-3-carboxylato-κ(2)
O
(2),O
(3))nickel(II) |
title_sort | bis(1h-imidazole-κn
(3))bis(2-oxidopyridinium-3-carboxylato-κ(2)
o
(2),o
(3))nickel(ii) |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977237/ https://www.ncbi.nlm.nih.gov/pubmed/21583420 http://dx.doi.org/10.1107/S1600536809028347 |
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