Recent advances in understanding blue copper proteins
EI Solomon, RG Hadt - Coordination Chemistry Reviews, 2011 - Elsevier
The type 1 (T1) or blue Cu (BC) proteins are a highly studied group of electron transfer (ET)
active sites in bioinorganic chemistry. In this review, we cover several more recent results …
active sites in bioinorganic chemistry. In this review, we cover several more recent results …
Metal–thiolate bonds in bioinorganic chemistry
Metal–thiolate active sites play major roles in bioinorganic chemistry. The M Sthiolate
bonds can be very covalent, and involve different orbital interactions. Spectroscopic features …
bonds can be very covalent, and involve different orbital interactions. Spectroscopic features …
Taking into account the ion-induced dipole interaction in the nonbonded model of ions
P Li, KM Merz Jr - Journal of chemical theory and computation, 2014 - ACS Publications
Metal ions exist in almost half of the proteins in the protein databank, and they serve as
structural, electron-transfer, and catalytic elements in the metabolic processes of organisms …
structural, electron-transfer, and catalytic elements in the metabolic processes of organisms …
Analysis of the palladium-catalyzed (aromatic) C–H bond metalation–deprotonation mechanism spanning the entire spectrum of arenes
SI Gorelsky, D Lapointe, K Fagnou - The Journal of organic …, 2012 - ACS Publications
A comprehensive understanding of the C–H bond cleavage step by the concerted
metalation–deprotonation (CMD) pathway is important in further development of cross …
metalation–deprotonation (CMD) pathway is important in further development of cross …
Modulating reactivity and diverting selectivity in palladium-catalyzed heteroaromatic direct arylation through the use of a chloride activating/blocking group
B Liégault, I Petrov, SI Gorelsky… - The Journal of Organic …, 2010 - ACS Publications
Through the introduction of an aryl chloride substituent, the selectivity of palladium-catalyzed
direct arylation may be diverted to provide alternative regioisomeric products in high yields …
direct arylation may be diverted to provide alternative regioisomeric products in high yields …
High-yielding palladium-catalyzed intramolecular alkane arylation: reaction development and mechanistic studies
M Lafrance, SI Gorelsky, K Fagnou - Journal of the American …, 2007 - ACS Publications
Palladium-catalyzed alkane arylation reactions with aryl halides are described for the
preparation of 2, 2-dialkyl-dihydrobenzofuran substrates. These reactions occur in excellent …
preparation of 2, 2-dialkyl-dihydrobenzofuran substrates. These reactions occur in excellent …
An organometallic sandwich lanthanide single-ion magnet with an unusual multiple relaxation mechanism
A dysprosium (III) sandwich complex,[DyIII (COT ″) 2Li (THF)(DME)], was synthesized using
1, 4-bis (trimethylsilyl) cyclooctatetraenyl dianion (COT ″). The complex behaves as a …
1, 4-bis (trimethylsilyl) cyclooctatetraenyl dianion (COT ″). The complex behaves as a …
Mechanism of N2O Reduction by the μ4-S Tetranuclear CuZ Cluster of Nitrous Oxide Reductase
Reaction thermodynamics and potential energy surfaces are calculated using density
functional theory to investigate the mechanism of the reductive cleavage of the N− O bond …
functional theory to investigate the mechanism of the reductive cleavage of the N− O bond …
An Organometallic Building Block Approach To Produce a Multidecker 4f Single-Molecule Magnet
JJ Le Roy, M Jeletic, SI Gorelsky… - Journal of the …, 2013 - ACS Publications
An organometallic building block strategy was employed to investigate the magnetic
properties of a LnIII organometallic single-ion magnet (SIM) and subsequent single …
properties of a LnIII organometallic single-ion magnet (SIM) and subsequent single …
Importance of Out-of-State Spin–Orbit Coupling for Slow Magnetic Relaxation in Mononuclear FeII Complexes
PH Lin, NC Smythe, SI Gorelsky… - Journal of the …, 2011 - ACS Publications
Two mononuclear high-spin FeII complexes with trigonal planar ([FeII (N (TMS) 2) 2
(PCy3)](1) and distorted tetrahedral ([FeII (N (TMS) 2) 2 (depe)](2) geometries are reported …
(PCy3)](1) and distorted tetrahedral ([FeII (N (TMS) 2) 2 (depe)](2) geometries are reported …