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Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc

In the title compound, [Zn(C(11)H(7)N(6))(2)(H(2)O)(2)], the Zn(II) cation, located on an inversion center, is N,N′-chelated by two 5-(pyrazin-2-yl)-3-(pyridin-3-yl)-1,2,4-triazolide anions and is further coordinated by two water mol­ecules in a distorted N(4)O(2) octa­hedral geometry. In the anioni...

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Autores principales: Wang, Ye-Nan, Dong, Wen-Wen
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998535/
https://www.ncbi.nlm.nih.gov/pubmed/24826085
http://dx.doi.org/10.1107/S1600536814004176
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author Wang, Ye-Nan
Dong, Wen-Wen
author_facet Wang, Ye-Nan
Dong, Wen-Wen
author_sort Wang, Ye-Nan
collection PubMed
description In the title compound, [Zn(C(11)H(7)N(6))(2)(H(2)O)(2)], the Zn(II) cation, located on an inversion center, is N,N′-chelated by two 5-(pyrazin-2-yl)-3-(pyridin-3-yl)-1,2,4-triazolide anions and is further coordinated by two water mol­ecules in a distorted N(4)O(2) octa­hedral geometry. In the anionic ligand, the pyrazine and pyridine rings are twisted with respect to the central triazole ring by 5.77 (10) and 11.54 (10)°, respectively. In the crystal, classical O—H⋯N and weak C—H⋯O hydrogen bonds and π–π stacking inter­actions between aromatic rings [the centroid–centroid distances between triazole and pyrazine rings, and between triazole and pyridine rings are 3.623 (2) and 3.852 (2) Å, respectively] connect the mol­ecules into a three-dimensional supra­molecular architecture.
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spelling pubmed-39985352014-05-13 Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc Wang, Ye-Nan Dong, Wen-Wen Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, [Zn(C(11)H(7)N(6))(2)(H(2)O)(2)], the Zn(II) cation, located on an inversion center, is N,N′-chelated by two 5-(pyrazin-2-yl)-3-(pyridin-3-yl)-1,2,4-triazolide anions and is further coordinated by two water mol­ecules in a distorted N(4)O(2) octa­hedral geometry. In the anionic ligand, the pyrazine and pyridine rings are twisted with respect to the central triazole ring by 5.77 (10) and 11.54 (10)°, respectively. In the crystal, classical O—H⋯N and weak C—H⋯O hydrogen bonds and π–π stacking inter­actions between aromatic rings [the centroid–centroid distances between triazole and pyrazine rings, and between triazole and pyridine rings are 3.623 (2) and 3.852 (2) Å, respectively] connect the mol­ecules into a three-dimensional supra­molecular architecture. International Union of Crystallography 2014-03-05 /pmc/articles/PMC3998535/ /pubmed/24826085 http://dx.doi.org/10.1107/S1600536814004176 Text en © Wang and Dong 2014 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
Wang, Ye-Nan
Dong, Wen-Wen
Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc
title Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc
title_full Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc
title_fullStr Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc
title_full_unstemmed Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc
title_short Di­aqua­bis­[5-(pyrazin-2-yl-κN (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κN (1)]zinc
title_sort di­aqua­bis­[5-(pyrazin-2-yl-κn (1))-3-(pyridin-3-yl)-1,2,4-triazolido-κn (1)]zinc
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998535/
https://www.ncbi.nlm.nih.gov/pubmed/24826085
http://dx.doi.org/10.1107/S1600536814004176
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