Structural insights and supramolecular description of Gliclazide and its Impurity F

SSRN Electronic Journal(2022)

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摘要
•Stability of Gliclazide in pharmaceutical formulations.•Hirshfeld surface is applied the study of intermolecular interactions.•The detailed DFT and NBO calculations have been performed on Gliclazide and its Impurity F.•The HOMO-LUMO and MEP are calculated and analyzed.
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关键词
Gliclazide,Molecular modeling,M062x/6–311++G**,DFT,QTAIM
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