Frank Neese and Edward I. Solomon*
Detailed Spectroscopic and Theoretical Studies on [Fe(EDTA)(O2)]3-: Electronic Structure of the Side-on Ferric−Peroxide Bond and Its Relevance to Reactivity
J. Am. Chem. Soc., 1998, 120 (49), pp 12829–12848
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http://dx.doi.org/10.1021/ja981561h