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Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II)

In the title complex, [Ni(SO(4))(C(5)H(8)N(2))(3)(H(2)O)(2)], the Ni(II) ion is coordinated by three facial 1-ethyl-1H-imidazole ligands, one monodentate sulfate ligand and two water mol­ecules in a slightly distorted octa­hedral coordination environment. In the crystal, two pairs of O—H⋯O hydrogen...

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Autores principales: Holczbauer, Tamas, Domjan, Attila, Fodor, Csaba
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4778827/
https://www.ncbi.nlm.nih.gov/pubmed/27006811
http://dx.doi.org/10.1107/S2056989016002863
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author Holczbauer, Tamas
Domjan, Attila
Fodor, Csaba
author_facet Holczbauer, Tamas
Domjan, Attila
Fodor, Csaba
author_sort Holczbauer, Tamas
collection PubMed
description In the title complex, [Ni(SO(4))(C(5)H(8)N(2))(3)(H(2)O)(2)], the Ni(II) ion is coordinated by three facial 1-ethyl-1H-imidazole ligands, one monodentate sulfate ligand and two water mol­ecules in a slightly distorted octa­hedral coordination environment. In the crystal, two pairs of O—H⋯O hydrogen bonds link complex mol­ecules, forming inversion dimers incorporating R (2) (4)(8), R (2) (2)(8) and R (2) (2)(12) rings. The dimeric unit also contains two symmetry-unique intra­molecular O—H⋯O hydrogen bonds. In addition, weak C—H⋯O hydrogen bonds, weak C—H⋯π inter­actions and π–π inter­actions with a centroid–centroid distance of 3.560 (2) Å combine to form a three-dimensional network. One of the ethyl groups is disordered over two sets of sites with occupancies in the ratio 0.586 (7):0.414 (7).
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spelling pubmed-47788272016-03-22 Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II) Holczbauer, Tamas Domjan, Attila Fodor, Csaba Acta Crystallogr E Crystallogr Commun Research Communications In the title complex, [Ni(SO(4))(C(5)H(8)N(2))(3)(H(2)O)(2)], the Ni(II) ion is coordinated by three facial 1-ethyl-1H-imidazole ligands, one monodentate sulfate ligand and two water mol­ecules in a slightly distorted octa­hedral coordination environment. In the crystal, two pairs of O—H⋯O hydrogen bonds link complex mol­ecules, forming inversion dimers incorporating R (2) (4)(8), R (2) (2)(8) and R (2) (2)(12) rings. The dimeric unit also contains two symmetry-unique intra­molecular O—H⋯O hydrogen bonds. In addition, weak C—H⋯O hydrogen bonds, weak C—H⋯π inter­actions and π–π inter­actions with a centroid–centroid distance of 3.560 (2) Å combine to form a three-dimensional network. One of the ethyl groups is disordered over two sets of sites with occupancies in the ratio 0.586 (7):0.414 (7). International Union of Crystallography 2016-02-20 /pmc/articles/PMC4778827/ /pubmed/27006811 http://dx.doi.org/10.1107/S2056989016002863 Text en © Holczbauer et al. 2016 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 Research Communications
Holczbauer, Tamas
Domjan, Attila
Fodor, Csaba
Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II)
title Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II)
title_full Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II)
title_fullStr Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II)
title_full_unstemmed Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II)
title_short Crystal structure of di­aqua­tris­(1-ethyl-1H-imidazole-κN (3))(sulfato-κO)nickel(II)
title_sort crystal structure of di­aqua­tris­(1-ethyl-1h-imidazole-κn (3))(sulfato-κo)nickel(ii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4778827/
https://www.ncbi.nlm.nih.gov/pubmed/27006811
http://dx.doi.org/10.1107/S2056989016002863
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