| 1 |
Formation of a Reactive, Alkyl Thiolate-Ligated Fe-III-Superoxo Intermediate Derived from Dioxygen
Blakely MN, Dedushko MA, Poon PCY, Villar-Acevedo G, Kovacs JA
Journal of the American Chemical Society, 141(5), 1867, 2019 |
| 2 |
How Metal Ion Lewis Acidity and Steric Properties Influence the Barrier to Dioxygen Binding, Peroxo O-O Bond Cleavage, and Reactivity
Poon PCY, Dedushko MA, Sun XR, Yang G, Toledo S, Hayes EC, Johansen A, Piquette MC, Rees JA, Stoll S, Rybak-Akimova E, Kovacs JA
Journal of the American Chemical Society, 141(38), 15046, 2019 |
| 3 |
How Do Ring Size and pi-Donating Thiolate Ligands Affect Redox-Active, alpha-Imino-N-heterocycle Ligand Activation?
Leipzig BK, Rees JA, Kowalska JK, Theisen RM, Kavcic M, Poon PCY, Kaminsky W, DeBeer S, Bill E, Kovacs JA
Inorganic Chemistry, 57(4), 1935, 2018 |
| 4 |
Iron L-2,L-3-Edge X-ray Absorption and X-ray Magnetic Circular Dichroism Studies of Molecular Iron Complexes with Relevance to the FeMoco and FeVco Active Sites of Nitrogenase
Kowalska JK, Nayyar B, Rees JA, Schiewer CE, Lee SC, Kovacs JA, Meyer F, Weyhermuller T, Otero E, DeBeer S
Inorganic Chemistry, 56(14), 8147, 2017 |
| 5 |
Metal-Assisted Oxo Atom Addition to an Fe(III) Thiolate
Villar-Acevedo G, Lugo-Mas P, Blakely MN, Rees JA, Ganas AS, Hanada EM, Kaminsky W, Kovacs JA
Journal of the American Chemical Society, 139(1), 119, 2017 |
| 6 |
Spatial Heat Maps from Fast Information Matching of Fast and Slow Degrees of Freedom: Application to Molecular Dynamics Simulations
Kovacs JA, Wriggers W
Journal of Physical Chemistry B, 120(33), 8473, 2016 |
| 7 |
X-ray Absorption and Emission Study of Dioxygen Activation by a Small-Molecule Manganese Complex
Rees JA, Martin-Diaconescu V, Kovacs JA, DeBeer S
Inorganic Chemistry, 54(13), 6410, 2015 |
| 8 |
Synthesis and Structural Characterization of a Series of (MnOR)-O-III Complexes, Including a Water-Soluble (MnOH)-O-III That Promotes Aerobic Hydrogen-Atom Transfer
Coggins MK, Brines LM, Kovacs JA
Inorganic Chemistry, 52(21), 12383, 2013 |
| 9 |
Isolation and Characterization of a Dihydroxo-Bridged Iron(III,III)(mu-OH)(2) Diamond Core Derived from Dioxygen
Coggins MK, Toledo S, Kovacs JA
Inorganic Chemistry, 52(23), 13325, 2013 |
| 10 |
Correlation Between Structural, Spectroscopic, and Reactivity Properties Within a Series of Structurally Analogous Metastable Manganese(III)-Alkylperoxo Complexes
Coggins MK, Martin-Diaconescu V, DeBeer S, Kovacs JA
Journal of the American Chemical Society, 135(11), 4260, 2013 |
