Weak noncovalent interactions in 1,2,4-triazole-3-thione-linked adamantyl derivatives: experimental and computational insights into their potential as antiproliferative agents

The synthesis, single-crystal X-ray structures, and antiproliferative activity of five adamantyl-linked 1,2,4-triazole-3-thione derivatives are presented. The crystal structures of the mono- and di-substituted chloro derivatives were analyzed in detail, revealing a variety of weak noncovalent intera...

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Bibliografische Detailangaben

Hauptverfasser:	Lamya H. Al-Wahaibi, Annesha Chakraborty, Hanan M. Hassan, Mohammed S. M. Abdelbaky, Santiago Garcia-Granda, Ali A. El-Emam, M. Judith Percino, Subbiah Thamotharan
Format:	Artigo
Sprache:	Inglês
Veröffentlicht:	Frontiers Media S.A. 2025-11-01
Schriftenreihe:	Frontiers in Chemistry
Schlagworte:	adamantyl 1,2,4-triazole weak noncovalent interactions chalcogen bond energy decomposition analysis
Online-Zugang:	https://www.frontiersin.org/articles/10.3389/fchem.2025.1691657/full
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