Open AccessStructural and Energetic Properties of Weak Noncovalent Interactions in Two Closely Related 3,6-Disubstituted-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Derivatives: In Vitro Cyclooxygenase Activity, Crystallography, and Computational Investigations
Author(s) -
Lamya H. Al-Wahaibi,
Karthikeyan Sekar,
Olivier Blacque,
Amal A. ElMasry,
Hanan M. Hassan,
M. Judith Percino,
Ali A. ElEmam,
Subbiah Thamotharan
Publication year - 2022
Publication title -
acs omega
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.779
H-Index - 40
ISSN - 2470-1343
DOI - 10.1021/acsomega.2c04252
Subject(s) - intermolecular force , hydrogen bond , non covalent interactions , chemistry , supramolecular chemistry , crystallography , stacking , supramolecular assembly , crystal structure , chalcogen , density functional theory , molecule , stereochemistry , computational chemistry , organic chemistry
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