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. Author manuscript; available in PMC: 2012 Jun 29.

Published in final edited form as: J Am Chem Soc. 2011 Jun 7;133(25):9762–9774. doi: 10.1021/ja109178q

Qualitative reaction coordinate of DMSOR with (CH₃)₃NO as substrate showing reactant (), intermediate (I), and product () potential energy surfaces. The transition state is defined as TS. This reaction coordinate is based on the calculated reaction coordinate shown in Figure S2. Dihedral angle is defined as S₁-S₂-S₃-S₄.

Inline graphic — Qualitative reaction coordinate of DMSOR with (CH₃)₃NO as substrate showing reactant (), intermediate (I), and product () potential energy surfaces. The transition state is defined as TS. This reaction coordinate is based on the calculated reaction coordinate shown in Figure S2. Dihedral angle is defined as S₁-S₂-S₃-S₄.