Understanding the role of water in aqueous ruthenium-catalyzed transfer hydrogenation of ketones

scientific article published on 27 August 2012

Understanding the role of water in aqueous ruthenium-catalyzed transfer hydrogenation of ketones is …
instance of (P31):
scholarly articleQ13442814

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P356DOI10.1002/CPHC.201200454
P698PubMed publication ID22927215

P2093author name stringAnna Pavlova
Evert Jan Meijer
P2860cites workUnified Approach for Molecular Dynamics and Density-Functional TheoryQ21706191
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron densityQ21708802
Density-functional exchange-energy approximation with correct asymptotic behaviorQ21709057
The Catalyst Precursor, Catalyst, and Intermediate in the RuII-Promoted Asymmetric Hydrogen Transfer between Alcohols and KetonesQ29541162
Asymmetric Transfer Hydrogenation of Aromatic Ketones Catalyzed by Chiral Ruthenium(II) ComplexesQ29999470
A multilateral mechanistic study into asymmetric transfer hydrogenation in waterQ31161692
Asymmetric transfer hydrogenation of ketones with bifunctional transition metal-based molecular catalystsQ34706704
Aqueous-phase asymmetric transfer hydrogenation of ketones--a greener approach to chiral alcoholsQ36847575
Towards an assessment of the accuracy of density functional theory for first principles simulations of water. II.Q46093166
A unified formulation of the constant temperature molecular dynamics methodsQ59540413
Chiral induction effects in ruthenium(II) amino alcohol catalysed asymmetric transfer hydrogenation of ketones: an experimental and theoretical approachQ74311640
Efficient pseudopotentials for plane-wave calculationsQ78207578
Realistic modeling of ruthenium-catalyzed transfer hydrogenationQ79824879
Accelerated asymmetric transfer hydrogenation of aromatic ketones in waterQ80265702
P433issue15
P304page(s)3492-3496
P577publication date2012-08-27
P1433published inChemPhysChemQ2012739
P1476titleUnderstanding the role of water in aqueous ruthenium-catalyzed transfer hydrogenation of ketones
P478volume13

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cites work (P2860)
Q53237780Dehydrogenation of formic acid by Ir-bisMETAMORPhos complexes: experimental and computational insight into the role of a cooperative ligand.
Q50041157Explicit Solvation Matters: Performance of QM/MM Solvation Models in Nucleophilic Addition
Q56739427How Solvent Affects C-H Activation and Hydrogen Production Pathways in Homogeneous Ru-Catalyzed Methanol Dehydrogenation Reactions
Q57904476Impact of the Ligand Flexibility and Solvent on the O–O Bond Formation Step in a Highly Active Ruthenium Water Oxidation Catalyst