In-depth DFT insights into the crucial role of hydrogen bonding network in CO2 fixation into propylene oxide promoted by Biomass-Derived deep eutectic solvents
Hermann Detz, Valeria Butera
Topics & Concepts
EpoxideHydrogen bondPropylene oxideChemistryPropylene carbonateNucleophileEutectic systemCatalysisDensity functional theoryPhotochemistryAcceptorMoleculeOxideCombinatorial chemistryComputational chemistryOrganic chemistryPhysical chemistryElectrolytePhysicsPolymerCopolymerEthylene oxideAlloyCondensed matter physicsElectrodeCarbon dioxide utilization in catalysisCatalysis for Biomass ConversionIonic liquids properties and applications