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

In the title compound, C H N O 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, mol-ecules are linked by weak C-H⋯O and C-H⋯N hydrogen bonds, forming the three-dimensional supra-molecular packing. π-π stacking between the quinoli...

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Bibliographic Details
Published in:Acta crystallographica. Section E, Crystallographic communications Crystallographic communications, 2017-02, Vol.73 (Pt 2), p.173-176
Main Authors: Bahoussi, Rawia Imane, Djafri, Ahmed, Chouaih, Abdelkader, Djafri, Ayada, Hamzaoui, Fodil
Format: Article
Language:English
Subjects:
1,2,4-triazole
crystal structure
Hirshfeld surface analysis
hydrogen bonding
Research Communications
π–π stacking
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Summary:In the title compound, C H N O 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, mol-ecules are linked by weak C-H⋯O and C-H⋯N hydrogen bonds, forming the three-dimensional supra-molecular packing. π-π stacking between the quinoline ring systems of neighbouring mol-ecules is also observed, the centroid-to-centroid distance being 3.6169 (6) Å. Hirshfeld surface (HS) analyses were performed.
ISSN:2056-9890
2056-9890
DOI:10.1107/S205698901700041X