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. Author manuscript; available in PMC: 2013 Aug 20.
Published in final edited form as: Chem Res Toxicol. 2012 Jul 31;25(8):1581–1597. doi: 10.1021/tx200526y

Figure 6.

Figure 6

Optimized structures of ONOOCO2– and the various spin adducts formed with DMPO showing charge and spin densities (in parentheses), and pertinent bond lengths at the PCM/B3LYP/6-31+G**//B3LYP/6-31* level of theory.