% V Bur index and steric maps: from predictive catalysis to machine learning

S Escayola, N Bahri-Laleh, A Poater - Chemical Society Reviews, 2024 - pubs.rsc.org
Steric indices are parameters used in chemistry to describe the spatial arrangement of
atoms or groups of atoms in molecules. They are important in determining the reactivity …

N-Heterocyclic Carbenes in Materials Chemistry

CA Smith, MR Narouz, PA Lummis, I Singh… - Chemical …, 2019 - ACS Publications
N-Heterocyclic carbenes (NHCs) have become one of the most widely studied class of
ligands in molecular chemistry and have found applications in fields as varied as catalysis …

Computational ligand descriptors for catalyst design

DJ Durand, N Fey - Chemical reviews, 2019 - ACS Publications
Ligands, especially phosphines and carbenes, can play a key role in modifying and
controlling homogeneous organometallic catalysts, and they often provide a convenient …

The measure of all rings—N‐heterocyclic carbenes

T Dröge, F Glorius - Angewandte Chemie International Edition, 2010 - Wiley Online Library
Quantification and variation of characteristic properties of different ligand classes is an
exciting and rewarding research field. N‐Heterocyclic carbenes (NHCs) are of special …

Percent buried volume for phosphine and N-heterocyclic carbene ligands: steric properties in organometallic chemistry

H Clavier, SP Nolan - Chemical Communications, 2010 - pubs.rsc.org
Electronic and steric ligand effects both play major roles in organometallic chemistry and
consequently in metal-mediated catalysis. Quantifying such parameters is of interest to …

Stable cyclic carbenes and related species beyond diaminocarbenes

M Melaimi, M Soleilhavoup… - Angewandte Chemie …, 2010 - Wiley Online Library
The success of homogeneous catalysis can be attributed largely to the development of a
diverse range of ligand frameworks that have been used to tune the behavior of various …

Selected patented cross-coupling reaction technologies

JP Corbet, G Mignani - Chemical reviews, 2006 - ACS Publications
Many significant products (drugs, materials, optical devices, etc.) commercialized or in the
development phase, possess aromatic carbon-carbon and aromatic carbonnitrogen bonds …

On the nature of the active species in palladium catalyzed Mizoroki–Heck and Suzuki–Miyaura couplings–homogeneous or heterogeneous catalysis, a critical review

NTS Phan, M Van Der Sluys… - Advanced Synthesis & …, 2006 - Wiley Online Library
A wide array of forms of palladium has been utilized as precatalysts for Heck and Suzuki
coupling reactions over the last 15 years. Historically, nearly every form of palladium used …

Palladium complexes of N‐heterocyclic carbenes as catalysts for cross‐coupling reactions—A synthetic chemist's perspective

EAB Kantchev, CJ O'Brien… - Angewandte Chemie …, 2007 - Wiley Online Library
Abstract Palladium‐catalyzed C C and C N bond‐forming reactions are among the most
versatile and powerful synthetic methods. For the last 15 years, N‐heterocyclic carbenes …

Well-defined N-heterocyclic carbenes− palladium (II) precatalysts for cross-coupling reactions

N Marion, SP Nolan - Accounts of chemical research, 2008 - ACS Publications
Metal-catalyzed cross-coupling reactions, notably those permitting C− C bond formation,
have witnessed a meteoritic development and are now routinely employed as a powerful …