4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate

The title compound, C(9)H(10)N(4)S·0.095H(2)O, consists of discrete 4-ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione mol­ecules and a disordered mol­ecule of water of hydration with partial occupancy, lying on a twofold rotation axis. The dihedral angle between the pyridine and triazole rings i...

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Detalles Bibliográficos
Autores principales: Zareef, Muhammad, Arfan, Muhammad, Iqbal, Rashid, Parvez, Masood
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961273/
https://www.ncbi.nlm.nih.gov/pubmed/21202426
http://dx.doi.org/10.1107/S1600536808011744
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author Zareef, Muhammad
Arfan, Muhammad
Iqbal, Rashid
Parvez, Masood
author_facet Zareef, Muhammad
Arfan, Muhammad
Iqbal, Rashid
Parvez, Masood
author_sort Zareef, Muhammad
collection PubMed
description The title compound, C(9)H(10)N(4)S·0.095H(2)O, consists of discrete 4-ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione mol­ecules and a disordered mol­ecule of water of hydration with partial occupancy, lying on a twofold rotation axis. The dihedral angle between the pyridine and triazole rings is 41.73 (8)°. In the crystal structure, mol­ecules are hydrogen bonded via triazole NH groups and pyridyl N atoms, forming chains parallel to the a axis.
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spelling pubmed-29612732010-12-30 4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate Zareef, Muhammad Arfan, Muhammad Iqbal, Rashid Parvez, Masood Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(9)H(10)N(4)S·0.095H(2)O, consists of discrete 4-ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione mol­ecules and a disordered mol­ecule of water of hydration with partial occupancy, lying on a twofold rotation axis. The dihedral angle between the pyridine and triazole rings is 41.73 (8)°. In the crystal structure, mol­ecules are hydrogen bonded via triazole NH groups and pyridyl N atoms, forming chains parallel to the a axis. International Union of Crystallography 2008-04-30 /pmc/articles/PMC2961273/ /pubmed/21202426 http://dx.doi.org/10.1107/S1600536808011744 Text en © Zareef et al. 2008 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 Organic Papers
Zareef, Muhammad
Arfan, Muhammad
Iqbal, Rashid
Parvez, Masood
4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate
title 4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate
title_full 4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate
title_fullStr 4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate
title_full_unstemmed 4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate
title_short 4-Ethyl-3-(3-pyrid­yl)-1H-1,2,4-triazole-5(4H)-thione 0.095-hydrate
title_sort 4-ethyl-3-(3-pyrid­yl)-1h-1,2,4-triazole-5(4h)-thione 0.095-hydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961273/
https://www.ncbi.nlm.nih.gov/pubmed/21202426
http://dx.doi.org/10.1107/S1600536808011744
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AT parvezmasood 4ethyl33pyridyl1h124triazole54hthione0095hydrate

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