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The Chemical Bond in Gold(I) Complexes with N-Heterocyclic Carbenes

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Gold(I) Complexes of Phosphaalkynes
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Density Functional Theory
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Towards an order- N DFT method
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Density-functional theory of atoms and molecules
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Understanding the M (NHC) (NHC = N-heterocyclic carbene) bond
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Gold complexes as potential anti-parasitic agents
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13C NMR Spectroscopy of “Arduengo-type” Carbenes and Their Derivatives
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N-Heterocyclic Carbenes in Late Transition Metal Catalysis
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Ruthenium-Based Heterocyclic Carbene-Coordinated Olefin Metathesis Catalysts
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Stable Carbenes
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Quinone-Annulated N-Heterocyclic Carbene−Transition-Metal Complexes: Observation of π-Backbonding Using FT-IR Spectroscopy and Cyclic Voltammetry
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Reversible C−F Bond Formation and the Au-Catalyzed Hydrofluorination of Alkynes
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The Chemical Bond between Au(I) and the Noble Gases. Comparative Study of NgAuF and NgAu + (Ng = Ar, Kr, Xe) by Density Functional and Coupled Cluster Methods
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Ion Pairing in Cationic Olefin−Gold(I) Complexes
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Density Functional Theory of Electronic Structure
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The Significance of π Interactions in Group 11 Complexes with N-Heterocyclic Carbenes
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Piano-Stool Iron(II) Complexes as Probes for the Bonding of N-Heterocyclic Carbenes: Indications for π-Acceptor Ability
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N-Heterocyclic Carbene−Transition Metal Complexes: Spectroscopic and Crystallographic Analyses of π-Back-bonding Interactions
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Electronic Properties of N-Heterocyclic Carbene (NHC) Ligands: Synthetic, Structural, and Spectroscopic Studies of (NHC)Platinum(II) Complexes
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N-Heterocyclic Carbene, Silylene, and Germylene Complexes of MCl (M = Cu, Ag, Au). A Theoretical Study 1
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A bonding model for gold(I) carbene complexes
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Probing the nature of gold–carbon bonding in gold–alkynyl complexes
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N-Heterocyclic carbenes in gold catalysis
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A combined NMR/DFT study on the ion pair structure of [(PR 1 2 R 2 )Au(η 2 -3-hexyne)]BF 4 complexes
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Intriguing mechanistic labyrinths in gold( i ) catalysis
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Quantifying and understanding the electronic properties of N-heterocyclic carbenes
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Relativistic regular two-component Hamiltonians
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Exact solutions of regular approximate relativistic wave equations for hydrogen-like atoms
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Geometry optimizations in the zero order regular approximation for relativistic effects
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Inhomogeneous Electron Gas
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Self-Consistent Equations Including Exchange and Correlation Effects
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Density-functional exchange-energy approximation with correct asymptotic behavior
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Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Self-Assembled Monolayers of Triazolylidenes on Gold and Mixed Gold/Dielectric Substrates
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Gold(I) and Gold(III) Complexes of Cyclic (Alkyl)(amino)carbenes
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Anomalous ligand effect in gold( i )-catalyzed intramolecular hydroamination of alkynes
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Structure and bonding of [(SIPr)AgX] (X = Cl, Br, I and OTf)
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Quantitative assessment of the carbocation/carbene character of the gold–carbene bond
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The divergent effects of strong NHC donation in catalysis
inferred← citeshttps://doi.org/10.1039/c6nj03299kopenalex-snapshot
Chrysin functionalized NHC–Au( i ) complexes: synthesis, characterization and effects on the nematode Caenorhabditis elegans
inferred← citeshttps://doi.org/10.1039/c6ob02827fopenalex-snapshot
Imidazo[1,5-a]pyridin-3-ylidenes as π-accepting carbene ligands: substituent effects on properties of N-heterocyclic carbenes
inferred← citeshttps://doi.org/10.1039/c6ra07780copenalex-snapshot
Mechanism of the gold( i )-catalyzed synthesis of imidazo-pyrimidines and imidazo-pyrazines via [3 + 2] dipolar cycloaddition: a DFT study
inferred← citeshttps://doi.org/10.1039/c7dt00961eopenalex-snapshot
π-Backbonding and non-covalent interactions in the JohnPhos and polyfluorothiolate complexes of gold( i )
inferred← citeshttps://doi.org/10.1039/c7dt02170dopenalex-snapshot
The ligand effect on the oxidative addition of dioxygen to gold( i )–hydride complexes
inferred← citeshttps://doi.org/10.1039/c7ob01457kopenalex-snapshot
The preference for dual-gold( i ) catalysis in the hydro(alkoxylation vs. phenoxylation) of alkynes
inferred← citeshttps://doi.org/10.1039/c8cy00510aopenalex-snapshot
The role of the metal in the dual-metal catalysed hydrophenoxylation of diphenylacetylene
inferred← citeshttps://doi.org/10.1039/d0cy01343aopenalex-snapshot
Hydration of alkynes catalyzed by [Au(X)(L)(ppy)]X in the green solvent γ-valerolactone under acid-free conditions: the importance of the pre-equilibrium step
inferred← citeshttps://doi.org/10.1039/d2sc00630hopenalex-snapshot
Unraveling differences in aluminyl and carbene coordination chemistry: bonding in gold complexes and reactivity with carbon dioxide
inferred← citeshttps://doi.org/10.1039/d3sc01126gopenalex-snapshot
Putting cyaphide in its place: determining the donor/acceptor properties of the κ C -cyaphido ligand
inferred← citeshttps://doi.org/10.1039/d4nr00143eopenalex-snapshot
Insight into the nature of carbon–metal bonding for N -heterocyclic carbenes in gold/silver complexes and nanoparticles using DFT-correlated Raman spectroscopy: strong evidence for π-backbonding
inferred← citeshttps://doi.org/10.1039/d5ce00724kopenalex-snapshot
Thiophenyl and benzothiophenyl gold isocyanide complexes: synthesis, structures, and aurophilic and gold-involving chalcogen bonding interactions
inferred← citeshttps://doi.org/10.1039/d5qi00539fopenalex-snapshot
Cumulative 2c–2e vs. 3c–2e π-back donations: conformation preferences in germylene gold( i ) complexes
inferred← citeshttps://doi.org/10.1063/1.4908537openalex-snapshot
Charge-displacement analysis via natural orbitals for chemical valence: Charge transfer effects in coordination chemistry
inferred← citeshttps://doi.org/10.1080/00268976.2015.1100344openalex-snapshot
Anab initioelectronic density study of the CH4–Ar, CH4–Xe, CH4–H2O and CH4–H2S complexes: insights into the nature of the intermolecular interaction
inferred← citeshttps://doi.org/10.1515/zpch-2016-0786openalex-snapshot
Bonding Situation of Bis-gold Chloride Complexes with N-heterocyclic Carbene-Analogues [(AuCl)2-NHEMe] (E=C – Pb) based on DFT Calculations
inferred← citeshttps://doi.org/10.3390/biomedicines10061417openalex-snapshot
Current Developments of N-Heterocyclic Carbene Au(I)/Au(III) Complexes toward Cancer Treatment
inferred← citeshttps://doi.org/10.3762/bjnano.12.21openalex-snapshot
Gold(I) N-heterocyclic carbene precursors for focused electron beam-induced deposition
inferred← citeshttps://doi.org/10.70675/1bbe1bd0zd7f2z461ezaa79z71662954a803openalex-snapshot
Syntheses of N-Heterocyclic carbenes-stabilized metallic nanoclusters and nanoparticles
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