Crystal structure and Hirshfeld surface analysis of 3-(3,5-di-meth-oxy-phen-yl)-5-[6-(1H-pyrazol-1-yl)pyridin-2-yl]-1H-1,2,4-triazole

3-(3,5-二甲氧基苯基)-5-[6-(1H-吡唑-1-基)吡啶-2-基]-1H-1,2,4-三唑的晶体结构和Hirshfeld表面分析

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Abstract

The title bis-azole-pyridine compound, C(18)H(16)N(6)O(2), crystallizes in the triclinic space group P1 (No. 2) with two independent mol-ecules in the asymmetric unit. The mol-ecular structure was analyzed using crystallographic techniques, confirming the expected configuration and bonding scheme. Hirshfeld surface analysis revealed key non-covalent inter-actions such as C-H⋯N/C/O and π-π stacking, which consolidate the crystal structure. The study provides valuable insights into the structural features and inter-mol-ecular inter-actions of this polydentate compound, which may have potential applications as a transition-metal ligand.

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