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Quantum-chemical Calculations of the Antioxidant Properties of trans-p-coumaric Acid and trans-sinapinic Acid

Urbaniak Alicja, Molski Marcin, Szeląg Małgorzata

Trans-p-coumaric and trans-sinapinic acids are cinnamic acid`s derivatives which show strong antioxidant properties. In this work full optimization of both chemical structures and their radical, cation radical and anionic forms in vacuum and water medium has been performed, and antioxidant descri ...