Generating Cu^II–Oxyl/Cu^III–Oxo Species from Cu^I–α-Ketocarboxylate Complexes and O₂: In Silico Studies on Ligand Effects and CH-Activation Reactivity

Full Citation

S.M. Huber, M.Z. Ertem, F. Aquilante, L. Gagliardi, W.B. Tolman, and C.J. Cramer, Generating Cu^II–Oxyl/Cu^III–Oxo Species from Cu^I–α-Ketocarboxylate Complexes and O₂: In Silico Studies on Ligand Effects and CH-Activation Reactivity, Chem. – Eur. J., 2009, 15, 4886–4895. DOI: 10.1002/chem.200802338