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Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate

In the title compound, [Zn(C(8)H(3)NO(6))(C(8)H(7)N(3))(2)(H(2)O)]·0.5H(2)O, the Zn(II) atom shows a distorted octa­hedral ZnN(4)O(2) coordination environment and is bonded to two 3-(2-pyrid­yl)-1H-pyrazole ligands via the N atoms, one monodentate 4-nitro­phthalate ligand and one associated water mo...

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Detalles Bibliográficos
Autores principales: Ni, Lei, Zhao, Ji-Li, Wei, Hong
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3050407/
https://www.ncbi.nlm.nih.gov/pubmed/21522519
http://dx.doi.org/10.1107/S1600536810051949
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author Ni, Lei
Zhao, Ji-Li
Wei, Hong
author_facet Ni, Lei
Zhao, Ji-Li
Wei, Hong
author_sort Ni, Lei
collection PubMed
description In the title compound, [Zn(C(8)H(3)NO(6))(C(8)H(7)N(3))(2)(H(2)O)]·0.5H(2)O, the Zn(II) atom shows a distorted octa­hedral ZnN(4)O(2) coordination environment and is bonded to two 3-(2-pyrid­yl)-1H-pyrazole ligands via the N atoms, one monodentate 4-nitro­phthalate ligand and one associated water mol­ecule. Additionally, one water of crystallization, with a site-occupation factor of 0.5, is present. The two 3-(2-pyrid­yl)-1H-pyrazole ligands are planar [r.m.s. deviations = 0.03 (1) and 0.35 (1) Å] and the dihedral angle between the two planar 3-(2-pyrid­yl)-1H-pyrazole ligands is 67.31 (4)°. Inter­molecular π–π stacking inter­actions between 3-(2-pyrid­yl)-1H-pyrazole ligands with a face-to-face separation of 3.64 (1) Å are observed. Moreover, the crystal structure is stabilized by O—H⋯O and N—H⋯O hydrogen bonds between the water of crystallization, the associated water mol­ecule and the 3-(2-pyrid­yl)-1H-pyrazole ligands.
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spelling pubmed-30504072011-04-26 Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate Ni, Lei Zhao, Ji-Li Wei, Hong Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, [Zn(C(8)H(3)NO(6))(C(8)H(7)N(3))(2)(H(2)O)]·0.5H(2)O, the Zn(II) atom shows a distorted octa­hedral ZnN(4)O(2) coordination environment and is bonded to two 3-(2-pyrid­yl)-1H-pyrazole ligands via the N atoms, one monodentate 4-nitro­phthalate ligand and one associated water mol­ecule. Additionally, one water of crystallization, with a site-occupation factor of 0.5, is present. The two 3-(2-pyrid­yl)-1H-pyrazole ligands are planar [r.m.s. deviations = 0.03 (1) and 0.35 (1) Å] and the dihedral angle between the two planar 3-(2-pyrid­yl)-1H-pyrazole ligands is 67.31 (4)°. Inter­molecular π–π stacking inter­actions between 3-(2-pyrid­yl)-1H-pyrazole ligands with a face-to-face separation of 3.64 (1) Å are observed. Moreover, the crystal structure is stabilized by O—H⋯O and N—H⋯O hydrogen bonds between the water of crystallization, the associated water mol­ecule and the 3-(2-pyrid­yl)-1H-pyrazole ligands. International Union of Crystallography 2010-12-24 /pmc/articles/PMC3050407/ /pubmed/21522519 http://dx.doi.org/10.1107/S1600536810051949 Text en © Ni et al. 2011 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
Ni, Lei
Zhao, Ji-Li
Wei, Hong
Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate
title Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate
title_full Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate
title_fullStr Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate
title_full_unstemmed Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate
title_short Aqua­(4-nitro­phthalato)bis­[2-(1H-pyrazol-3-yl)pyridine]­zinc(II) hemihydrate
title_sort aqua­(4-nitro­phthalato)bis­[2-(1h-pyrazol-3-yl)pyridine]­zinc(ii) hemihydrate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3050407/
https://www.ncbi.nlm.nih.gov/pubmed/21522519
http://dx.doi.org/10.1107/S1600536810051949
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