Extended Data Fig. 3: Optimal structures for transition states and key intermediates.
From: Photoenzymatic stereoablative enantioconvergence of γ-chiral oximes via hydrogen atom transfer
Calculations were performed at the um062x-D3/def2tzvpp (SMD, ε = 4.0) // um062x-D3/def2svp (gas) level. Note that the atoms were held constant during geometry optimization, highlighted by green.
