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The reactivity of 2,3-dichoro-1,4-naphthoquinone with difunctional nucleophiles (2-mercaptoethanol, 1,2-ethanedithiol, 2-aminoethanol and ethylene glycol) was investigated in mild conditions. Using DFT calculations (B3LYP/6–31++G(d,p) and M11/6–31++G(d,p)), we identified intramolecular interactions in the 2-(substituted)-3-chloro-1,4-naphthoquinone derivatives, which modify the electrophilicity and...
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