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. Author manuscript; available in PMC: 2018 Jun 4.
Published in final edited form as: Inorg Chem. 2016 Jun 14;55(13):6364–6375. doi: 10.1021/acs.inorgchem.6b01034

Figure 16.

Figure 16

Reductive cleavage of the O–O bond by the TNC. (A) 2D potential energy surface (path 1 for high pH and path 2 for low pH). (B) FMOs associated with the TNC leading to the low barrier for O–O cleavage. T2 and T3A are reduced, and T3B is oxidized.