6533b834fe1ef96bd129cc36

RESEARCH PRODUCT

Computational Investigation of Alkynols and Alkyndiols Hydrogenation on a Palladium Cluster

Antonio PrestianniDario DucaFrancesco Ferrante

subject

Palladium cluster hydrogenation reactions unsaturated alcoholschemistry.chemical_elementPhotochemistrySymmetry (physics)3. Good healthSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsReduction (complexity)General EnergychemistryCluster (physics)Physical chemistryReaction pathPhysical and Theoretical ChemistryPalladium

description

The reaction path leading to the partial and total reduction of alkynols and alkyndiols with general formula R–CH2–C≡C–CH(OH)–R′ and R–CH(OH)–C≡C–CH(OH)–R′ (R, R′ = H, CH3) on a D3h symmetry Pd9 cl...

https://doi.org/10.1021/jp410878j