N-heterocyclic carbene adducts of main group elements and their use as ligands in transition metal chemistry
N-Heterocyclic carbenes (NHC) are nowadays ubiquitous and indispensable in many
research fields, and it is not possible to imagine modern transition metal and main group …
research fields, and it is not possible to imagine modern transition metal and main group …
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 …
controlling homogeneous organometallic catalysts, and they often provide a convenient …
Energy decomposition analysis
L Zhao, M von Hopffgarten… - Wiley …, 2018 - Wiley Online Library
The energy decomposition analysis (EDA) is a powerful method for a quantitative
interpretation of chemical bonds in terms of three major components. The instantaneous …
interpretation of chemical bonds in terms of three major components. The instantaneous …
N-heterocyclic carbene complexes of copper, nickel, and cobalt
AA Danopoulos, T Simler, P Braunstein - Chemical reviews, 2019 - ACS Publications
The emergence of N-heterocyclic carbenes as ligands across the Periodic Table had an
impact on various aspects of the coordination, organometallic, and catalytic chemistry of the …
impact on various aspects of the coordination, organometallic, and catalytic chemistry of the …
Stable abnormal N-heterocyclic carbenes and their applications
Although N-heterocyclic carbenes (NHCs) have been known as ligands for organometallic
complexes since the 1960s, these carbenes did not attract considerable attention until …
complexes since the 1960s, these carbenes did not attract considerable attention until …
Beyond click chemistry–supramolecular interactions of 1, 2, 3-triazoles
B Schulze, US Schubert - Chemical Society Reviews, 2014 - pubs.rsc.org
The research on 1, 2, 3-triazoles has been lively and ever-growing since its stimulation by
the advent of click chemistry. The attractiveness of 1H-1, 2, 3-triazoles and their derivatives …
the advent of click chemistry. The attractiveness of 1H-1, 2, 3-triazoles and their derivatives …
Highly Robust CuI‐TADF Emitters for Vacuum‐Deposited OLEDs with Luminance up to 222 200 cd m−2 and Device Lifetimes (LT90) up to 1300 hours at an Initial …
A critical step in advancing the practical application of copper‐based organic light‐emitting
diodes (OLEDs) is to bridge the large gap between device efficiency and operational …
diodes (OLEDs) is to bridge the large gap between device efficiency and operational …
Density functional theory for transition metals and transition metal chemistry
CJ Cramer, DG Truhlar - Physical Chemistry Chemical Physics, 2009 - pubs.rsc.org
We introduce density functional theory and review recent progress in its application to
transition metal chemistry. Topics covered include local, meta, hybrid, hybrid meta, and …
transition metal chemistry. Topics covered include local, meta, hybrid, hybrid meta, and …
Energy decomposition analysis
M Hopffgarten, G Frenking - Wiley Interdisciplinary Reviews …, 2012 - Wiley Online Library
The energy decomposition analysis (EDA) is a powerful method for a quantitative
interpretation of chemical bonds in terms of three major expressions. The instantaneous …
interpretation of chemical bonds in terms of three major expressions. The instantaneous …
Pushing Electrons Which Carbene Ligand for Which Application?
D Munz - Organometallics, 2018 - ACS Publications
This tutorial explores the diversity and characteristics of C-donor ligands. Particular
emphasis is put on the conceptual design of the electronic properties for applications in …
emphasis is put on the conceptual design of the electronic properties for applications in …