Title of article :
Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Author/Authors :
Bahoussi, Rawia Imane Laboratory of Technology and Solid Properties (LTPS) - Abdelhamid Ibn Badis University, Algeria , Djafri, Ahmed Laboratory of Technology and Solid Properties (LTPS) - Abdelhamid Ibn Badis University, Algeria , Chouaih, Abdelkader Laboratory of Technology and Solid Properties (LTPS) - Abdelhamid Ibn Badis University, Algeria , Djafri, Ayada Laboratory of Applied Organic Synthesis(LSOA) - Department of Chemistry - Faculty of Sciences - University of Oran 1 – Ahmed Ben Bella, Algeria , Hamzaoui, Fodil Laboratory of Technology and Solid Properties (LTPS) - Abdelhamid Ibn Badis University, Algeria
Abstract :
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.
Keywords :
crystal structure , Hirshfeld surface analysis , 1,2,4-triazole , hydrogen bonding , π–π stacking
Journal title :
Acta Crystallographica Section E: Crystallographic Communications
