Computational Insights into Catalytic Transformations, Volume 75 in the Advances in Catalysis series, highlights new advances in the field, with this new volume presenting interesting chapters on topics including Quantum Chemical Investigations on Electrophilic F/CF3/SCF3 Transfer Hypervalent Iodine Reagents, Combining DFT and experimental studies in enantioselective catalysis. From rationalization to prediction, Molecular Modelling of encapsulation and reactivity within metallocages, On the role of computational chemistry in the design of artificial metalloenzymes, and Computational Modelling of Catalytic Oxidation Reactions with H2O2 promoted by transition metal-substituted polyoxometalates.
- Provides the authority and expertise of leading contributors from an international board of authors
- Presents the latest release in Advances in Catalysis serials
- Updated release includes the latest information in the field
Sprache
Verlagsort
Verlagsgruppe
Elsevier Science & Techn.
Dateigröße
ISBN-13
978-0-443-31335-6 (9780443313356)
Schweitzer Klassifikation
1. Quantum Chemical Investigations on Electrophilic F/CF3/SCF3 Transfer Hypervalent Iodine ReagentsFahmi Himo and Maria Biosca2. Combining DFT and experimental studies in enantioselective catalysis. From rationalization to predictionMontserrat Diéguez, Oscar Pàmies and Maria Biosca3. Molecular Modelling of encapsulation and reactivity within metallocagesGregori Ujarque, Mercè Alemany-Chavarria and Giuseppe Sciortino4. On the role of computational chemistry in the design of artificial metalloenzymesJean-Didier Maréchal and Agusti Lledós5. Computational Modelling of Catalytic Oxidation Reactions with H2O2 promoted by transition metal-substituted polyoxometalatesAlbert Solé and Jordi J. Carbó
