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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...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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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). |
format | Online Article Text |
id | pubmed-4778827 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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