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. Author manuscript; available in PMC: 2011 Sep 20.
Published in final edited form as: Inorg Chem. 2010 Sep 20;49(18):8310–8322. doi: 10.1021/ic100870v

Figure 1.

Figure 1

DFT-optimized structure of 1-OH. In the structure optimization, the Me- and MeO-substituents of ligand L have been replaced by hydrogen atoms. This optimized structure is similar to that of diiron(IV) complex 4.