Stuart A. Macgregor

Computational Study of the Mechanism of Cyclometalation by Palladium Acetate

David L. Davies, Steven M. A. Donald, Stuart A. Macgregor · Journal of the American Chemical Society · 2005 · 711 citations

Cross-coupling Reaction, Engineering, Heterocyclic +15

C−F and C−H Bond Activation of Fluorobenzenes and Fluoropyridines at Transition Metal Centers: How Fluorine Tips the Scales

Eric Clot, Odile Eisenstein, Naseralla A. Jasim et al. · Accounts of Chemical Research · 2011 · 469 citations

Engineering, Molecule-based Material, Chemistry +18

Mechanisms of C–H bond activation: rich synergy between computation and experiment

Y. Boutadla, David L. Davies, Stuart A. Macgregor et al. · Dalton Transactions · 2009 · 438 citations · Full text

Inorganic Chemistry, Lone Pair Assistance, Engineering +15

Synthesis, Electronic Structure, and Magnetism of [Ni(6-Mes)₂]⁺: A Two-Coordinate Nickel(I) Complex Stabilized by Bulky N-Heterocyclic Carbenes

Rebecca C. Poulten, Michael J. Page, Andrés G. Algarra et al. · Journal of the American Chemical Society · 2013 · 264 citations

Orbital Degeneracy, Magnetic Properties, Engineering +16

Electrophilic C−H Activation at {Cp*Ir}:  Ancillary-Ligand Control of the Mechanism of C−H Activation

David L. Davies, Steven M. A. Donald, O. Al-Duaij et al. · Journal of the American Chemical Society · 2006 · 253 citations

Inorganic Chemistry, Engineering, Biochemistry +15