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Introduction of 5-Membered Boron, Oxygen-Heterocyclic Carbene and its Si and Ge Homologues and the M−L Bonding Analysis in Their Complexes with Coinage Metals: A Theoretical Study

https://doi.org/10.2139/ssrn.4618389
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Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/anie.199721621openalex-extracted
N‐Heterocyclic Carbenes
inferredcites →https://doi.org/10.1007/s13738-015-0748-zopenalex-extracted
Theoretical studies on structures, stability and nature of C → E (E = Si, Sn) bond in some derivatives of bitriazole-base NHC complexes with five-membered chelate rings
inferredcites →https://doi.org/10.1007/s13738-017-1216-8openalex-extracted
2-Morpholinoethyl-substituted N-heterocyclic carbene (NHC) precursors and their silver(I)NHC complexes: synthesis, crystal structure and in vitro anticancer properties
inferredcites →https://doi.org/10.1016/b978-0-12-821978-2.00021-0openalex-extracted
Energy Decomposition Analysis of the Chemical Bond: Scope and Limitation
inferredcites →https://doi.org/10.1016/j.ccr.2006.10.004openalex-extracted
Stereoelectronic parameters associated with N-heterocyclic carbene (NHC) ligands: A quest for understanding
inferredcites →https://doi.org/10.1016/j.mencom.2021.03.011openalex-extracted
Nature of metal–NHC bonds in some potential anticancer [(NHC(R))2→M]+ (M = CuI, AgI, AuI, R =n-propyl, n-butyl, n-pentyl, n-hexyl, n-heptyl, n-octyl, n-nonyl, n-decyl) complexes
inferredcites →https://doi.org/10.1016/j.molstruc.2021.132192openalex-extracted
On the nature of M L bond and the puckering of some B-heterocyclic carbenes and silylenes in their relevant complexes with coinage metals: A theoretical quest
inferredcites →https://doi.org/10.1016/s0010-8545(02)00285-0openalex-extracted
Towards a rigorously defined quantum chemical analysis of the chemical bond in donor–acceptor complexes
inferredcites →https://doi.org/10.1021/acs.chemrev.8b00722openalex-extracted
Chemical Bonding and Bonding Models of Main-Group Compounds
inferredcites →https://doi.org/10.1021/acs.inorgchem.8b00174openalex-extracted
Computational Investigation of Carbene–Phosphinidenes: Correlation between 31P Chemical Shifts and Bonding Features to Estimate the π-Backdonation of Carbenes
inferredcites →https://doi.org/10.1021/acs.jpca.7b01153openalex-extracted
Quantum Mechanical Study of N-Heterocyclic Carbene Adsorption on Au Surfaces
inferredcites →https://doi.org/10.1021/acs.jpclett.3c01397openalex-extracted
A Free Energy Decomposition Analysis: Insight into Binding Thermodynamics from Absolutely Localized Molecular Orbitals
inferredcites →https://doi.org/10.1021/cr940472uopenalex-extracted
Stable Carbenes
inferredcites →https://doi.org/10.1021/ct800503dopenalex-extracted
A Combined Charge and Energy Decomposition Scheme for Bond Analysis
inferredcites →https://doi.org/10.1021/ja050129eopenalex-extracted
A Stable N-Heterocyclic Carbene with a Diboron Backbone
inferredcites →https://doi.org/10.1021/jo300745eopenalex-extracted
On the Organocatalytic Activity of N-Heterocyclic Carbenes: Role of Sulfur in Thiamine
inferredcites →https://doi.org/10.1039/c4cs00375fopenalex-extracted
Energy decomposition analysis approaches and their evaluation on prototypical protein–drug interaction patterns
inferredcites →https://doi.org/10.1039/c5dt03501eopenalex-extracted
Annulated boron substituted N-heterocyclic carbenes: theoretical prediction of highly electrophilic carbenes
inferredcites →https://doi.org/10.1039/c5ra04911copenalex-extracted
A quest for stable 2,5-bis(halobora)cyclopentenylidene and its Si, Ge, Sn and Pb analogs at theoretical levels
inferredcites →https://doi.org/10.1073/pnas.0604761103openalex-extracted
Stable four-π-electron, four-membered heterocyclic cations and carbenes
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