Antioxidant Properties of Lapachol and Its Derivatives and Their Ability to Chelate Iron (II) Cation: DFT and QTAIM Studies

<div>Correlation between the MIA (kJ/mol) and retained charge (Q/e) of Fe in <b>k</b><sup><b>3</b></sup><b>-(O</b><sub><b>3</b></sub><b>,C=C)</b> coordination mode.</div>

Bioinorganic Chemistry and Applications

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Figure 4

Figure 4: Antioxidant Properties of Lapachol and Its Derivatives and Their Ability to Chelate Iron (II) Cation: DFT and QTAIM Studies 