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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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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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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. |
format | Online Article Text |
id | pubmed-3998535 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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