Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate

In the title compound, C(18)H(20)N(4)O(3)S, the 1,2,4-triazole ring is twisted with respect to the mean plane of quinoline moiety at 65.24 (4)°. In the crystal, mol­ecules are linked by weak C—H⋯O and C—H⋯N hydrogen bonds, forming the three-dimensional supra­molecular packing. π–π stacking between t...

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Autores principales: Bahoussi, Rawia Imane, Djafri, Ahmed, Chouaih, Abdelkader, Djafri, Ayada, Hamzaoui, Fodil
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5290559/
https://www.ncbi.nlm.nih.gov/pubmed/28217336
http://dx.doi.org/10.1107/S205698901700041X
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author Bahoussi, Rawia Imane
Djafri, Ahmed
Chouaih, Abdelkader
Djafri, Ayada
Hamzaoui, Fodil
author_facet Bahoussi, Rawia Imane
Djafri, Ahmed
Chouaih, Abdelkader
Djafri, Ayada
Hamzaoui, Fodil
author_sort Bahoussi, Rawia Imane
collection PubMed
description In the title compound, C(18)H(20)N(4)O(3)S, the 1,2,4-triazole ring is twisted with respect to the mean plane of quinoline moiety at 65.24 (4)°. In the crystal, mol­ecules are linked by weak C—H⋯O and C—H⋯N hydrogen bonds, forming the three-dimensional supra­molecular packing. π–π stacking between the quinoline ring systems of neighbouring mol­ecules is also observed, the centroid-to-centroid distance being 3.6169 (6) Å. Hirshfeld surface (HS) analyses were performed.
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spelling pubmed-52905592017-02-17 Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate Bahoussi, Rawia Imane Djafri, Ahmed Chouaih, Abdelkader Djafri, Ayada Hamzaoui, Fodil Acta Crystallogr E Crystallogr Commun Research Communications In the title compound, C(18)H(20)N(4)O(3)S, the 1,2,4-triazole ring is twisted with respect to the mean plane of quinoline moiety at 65.24 (4)°. In the crystal, mol­ecules are linked by weak C—H⋯O and C—H⋯N hydrogen bonds, forming the three-dimensional supra­molecular packing. π–π stacking between the quinoline ring systems of neighbouring mol­ecules is also observed, the centroid-to-centroid distance being 3.6169 (6) Å. Hirshfeld surface (HS) analyses were performed. International Union of Crystallography 2017-01-13 /pmc/articles/PMC5290559/ /pubmed/28217336 http://dx.doi.org/10.1107/S205698901700041X Text en © Bahoussi et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
Bahoussi, Rawia Imane
Djafri, Ahmed
Chouaih, Abdelkader
Djafri, Ayada
Hamzaoui, Fodil
Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate
title Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate
title_full Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate
title_fullStr Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate
title_full_unstemmed Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate
title_short Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4H-1,2,4-triazol-3-yl]sulfan­yl}acetate
title_sort crystal structure and hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymeth­yl)-4h-1,2,4-triazol-3-yl]sulfan­yl}acetate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5290559/
https://www.ncbi.nlm.nih.gov/pubmed/28217336
http://dx.doi.org/10.1107/S205698901700041X
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