Synthesis, crystal structure and Hirshfeld surface analysis of ( Z )-2-({amino[6-phenyl-3-(4-methylphenyl)-1,2,4-triazin-5-yl]methylidene}amino)-6-methoxybenzo[ d ]thiazole-4,7-diyl diacetate
Year: 2026
Type: article
Abstract: The stable conformation of the title molecule, C 29 H 24 N 6 O 5 S, is caused by two intramolecular N—H...N hydrogen bonds producing fused S (5) and S (6) rings. In the crystal, molecules are connected by intermolecular N—H...O interactions along the b -axis direction, forming C (9) chains. Furthermore, there are π–π interactions [centroid–to-centroid distance = 3.8200 (12) Å] between the benzene ring of the p -tolyl group and the 1,2,4-triazine ring in the same direction. As a result, the molecules form ribbons along the b -axis direction,. A Hirshfeld surface analysis was performed, showing the predominance of H...H, O...H/H...O, C...H/H...C and N...H/H...N contacts.
Institutions: Ural Federal University, Institute of Organic Synthesis, Ural Branch of the Russian Academy of Sciences, Sirius University of Science and Technology, M.N. Mikheev Institute of Metal Physics, Jimma University, Erciyes University, Azerbaijan State Pedagogical University, Azerbaijan Medical University, Baku Engineering University
Language: English
Subfield: Inorganic Chemistry
Field: Chemistry
Domain: Physical Sciences
Open Access status: gold
Estimated APC paid: $500
OpenAlex ID: W7211925002