The Effect of Photoisomerization on the Antioxidant Properties of Sinapic Acid and Methyl Sinapate in Different Solvents: A DFT/TD-DFT Study

The impact of photoisomerization on antioxidant properties holds significant implications for fields such as medicine, chemistry, and consumer products. This investigation employs multistate complete active space second-order perturbation theory (MS-CASPT2), complemented by density functional theory...

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Bibliographic Details
Main Authors: Lei Wang, Chaofan Sun, Lingling Wang
Format: Article
Language:English
Published: MDPI AG 2025-05-01
Series:Antioxidants
Subjects:
Online Access:https://www.mdpi.com/2076-3921/14/6/633
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