Keywords: انتقال الکترون دیسکوپی; Electrocatalysis; Dissociative electron transfer; Silver electrode; Copper electrode; Carbon-bromine bond;
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Keywords: انتقال الکترون دیسکوپی; AEA; adiabatic electron affinity; 5FU; 5-fluorocil; G; Guanine; HOMO; highest occupied molecular orbital; LUMO; lowest unoccupied molecular orbital; ET; electron transfer; DET; dissociative electron transfer; PCET; proton coupled electron transfer; NAPCET
Keywords: انتقال الکترون دیسکوپی; Molecular electrocatalysis; Dissociative electron transfer; Anchoring groups; Bromothiophenes; Gold electrodes; Silver electrodes
Keywords: انتقال الکترون دیسکوپی; Dissociative electron transfer; Reduction of tert-butyl bromide; MD simulations; Transfer coefficient; Saddle point avoidance
Keywords: انتقال الکترون دیسکوپی; ATRP; Inner-sphere electron transfer; Activation mechanism; Dissociative electron transfer; Halogen atom abstraction;
Kinetic solvent effects in the reduction of alkyl halides by {Sm[N(SiMe3)2]2(THF)2}
Keywords: انتقال الکترون دیسکوپی; Samarium; Dissociative electron transfer; Solvation; Inner-sphere;
The Reduction Potential of Diphenyliodonium Polymerisation Photoinitiator Is Not â0.2Â V vs. SCE. A Computational Study
Keywords: انتقال الکترون دیسکوپی; Diaryliodonium cation; redox potential calculation; dissociative electron transfer; coupled cluster calculations; DFT calculations;
Electroreduction mechanism of N-phenylhydroxylamines in aprotic solvents: N-(2-nitrophenyl)- and N-(3-nitrophenyl)hydroxylamines
Keywords: انتقال الکترون دیسکوپی; N-aryl hydroxylamines; cyclic voltammetry; quantum chemical calculations; radical anion; dissociative electron transfer;
Localized TiIII mediated dissociative electron transfer for carbon halogen bond activation on TiO2
Keywords: انتقال الکترون دیسکوپی; Photocatalytic dehalogenation; Carbon-halogen bond activation; Monochloroacetic acid; Dissociative electron transfer; Titanium dioxide;
Electrochemical reduction of organic bromides in 1-butyl-3-methylimidazolium tetrafluoroborate
Keywords: انتقال الکترون دیسکوپی; Electrocatalysis; Dissociative electron transfer; Silver electrode; Copper electrode; Carbon-bromine bond;
Platinum anti-cancer drugs: Free radical mechanism of Pt-DNA adduct formation and anti-neoplastic effect
Keywords: انتقال الکترون دیسکوپی; G=Guan; guanine, guanosine; HOMO; highest occupied molecular orbital; LUMO; lowest occupied molecular orbital; AIE; adiabatic ionisation energy; AEA; adiabatic electron affinity; TS; transition state; ÎEâ¡; TS activation energy; ÎG; change in free ener
The solvent effect on the electrocatalytic cleavage of carbon-halogen bonds on Ag and Au
Keywords: انتقال الکترون دیسکوپی; Dissociative electron transfer; electrocatalysis; solvent effect; reductive cleavage; carbon-halogen bond
Stepwise and concerted dissociative electron transfer onto a σ*-type orbital in polybrominated aromatics
Keywords: انتقال الکترون دیسکوپی; Dissociative electron transfer; Aromatic halides; Polybrominated aromatics; Convolution analysis; DFT calculations; σ* Radical anions
Electroreduction mechanism of N-arylhydroxylamines in aprotic solvents: N-(4-nitrophenyl)hydroxylamine
Keywords: انتقال الکترون دیسکوپی; N-aryl hydroxylamines; Cyclic voltammetry; Chronoamperometry; Quantum chemical calculations; Radical anion; Dissociative electron transfer
Reductive debromination of decabromodiphenyl ether yields brominated dibenzofurans in a Pschorr-type cyclisation
Keywords: انتقال الکترون دیسکوپی; Decabromodiphenyl ether; Dissociative electron transfer; Brominated dibenzofurans; Pschorr-type cyclization; Density functional; Calculations;
Relationship between supporting electrolyte bulkiness and dissociative electron transfer at catalytic and non-catalytic electrodes
Keywords: انتقال الکترون دیسکوپی; Dissociative electron transfer; Aryl halides; Electrocatalytic silver electrode; Supporting electrolyte effect; Electron tunnelling
Evidence for formation of ion pair stabilized diiodomethane radical anion in 1-butyl-3-methylimidazolium tetrafluoroborate room temperature ionic liquid
Keywords: انتقال الکترون دیسکوپی; 1-Butyl-3-methylimidazolium tetrafluoroborate; Diiodomethane; Marcus–Hush quadratic activation; Dissociative electron transfer; Room temperature ionic liquid; Cyclic voltammetry
Comparison of temperature effect on electroreduction of tert-butyl chloride and tert-butyl bromide—Theoretical study
Keywords: انتقال الکترون دیسکوپی; Dissociative electron transfer; Reduction of tert-butyl halides; MD simulations; Transfer coefficient; Reaction mechanism
Is glassy carbon a really inert electrode material for the reduction of carbon–halogen bonds?
Keywords: انتقال الکترون دیسکوپی; Glassy carbon; Surface oxides; Organic halides; Dissociative electron transfer
On the possibility of STM-control of dissociative electron transfer
Keywords: انتقال الکترون دیسکوپی; in situ STM; Dissociative electron transfer; Anti-bonding orbital; Tunneling
Theoretical study on the reduction behaviour of sulphur containing heterocycles. I Cleavage reaction of the C–S bond in the dibenzo[b,e]thiepinonesulphone class
Keywords: انتقال الکترون دیسکوپی; Reduction processes; Heterocyclic sulphones; Dissociative electron transfer; Solvent dependent calculations; Ab initio calculations
Electron transfer to sulfides:
Keywords: انتقال الکترون دیسکوپی; Dissociative electron transfer; Intrinsic barrier; Sulfide reduction; Bond cleavage; Self-protonation;