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

Acta Crystallographica Section E: Crystallographic Communications

Ayada Djafri¹  Rawia Imane Bahoussi²  Abdelkader Chouaih²  Ahmed Djafri²  Fodil Hamzaoui² 

[1] Laboratory of Applied Organic Synthesis(LSOA), Department of Chemistry, Faculty of Sciences, University of Oran 1 – Ahmed Ben Bella, 31000 Oran, Algeria;Laboratory of Technology and Solid Properties (LTPS), Abdelhamid Ibn Badis University, BP 227 Mostaganem 27000, Algeria;

关键词: crystal structure;    hydrogen bonding;    π–π stacking;    1,2,4-triazole;    Hirshfeld surface analysis;   

DOI  :  10.1107/S205698901700041X

来源: DOAJ

【 摘 要 】

In the title compound, C18H20N4O3S, 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.

【 授权许可】

Unknown