Bio-Inspired Transition Metal-Organic Hydride Conjugates for Catalysis of Transfer Hydrogenation: Experiment and Theory

Advances in Catalyst Systems for the Asymmetric Hydrogenation and Transfer Hydrogenation of Ketones

(2014) Bogdan Štefane et al.   CATALYSIS REVIEWS-SCIENCE AND ENGINEERING

An Easy One-Pot Synthesis of Diverse 2,5-Di(2-pyridyl)pyrroles: A Versatile Entry Point to Metal Complexes of Functionalised, Meridial and Tridentate 2,5-Di(2-pyridyl)pyrrolato Ligands

(2014) Alex McSkimming et al.   CHEMISTRY-A EUROPEAN JOURNAL

Explicitly correlated coupled cluster benchmarks with realistic-sized ligands for some late-transition metal reactions: basis sets convergence and performance of more approximate methods

(2014) Manoj K. Kesharwani et al.   THEORETICAL CHEMISTRY ACCOUNTS

Catalyst Activation by Loss of Cyclopentadienyl Ligands in Hydrogen Transfer Catalysis with Cp*IrIII Complexes

(2014) Jesús Campos et al.   ACS Catalysis

Molecular Photoelectrocatalysts for Visible Light-Driven Hydrogen Evolution from Neutral Water

(2014) Catherine L. Pitman et al.   ACS Catalysis

Bio-Inspired Catalytic Imine Reduction by Rhodium Complexes with Tethered Hantzsch Pyridinium Groups: Evidence for Direct Hydride Transfer from Dihydropyridine to Metal-Activated Substrate

(2013) Alex McSkimming et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

The coordination chemistry of organo-hydride donors: new prospects for efficient multi-electron reduction

(2013) Alex McSkimming et al.   CHEMICAL SOCIETY REVIEWS

Macrocyclic Bis(phenanthroline-pyrrole): A Convenient One-Pot Synthesis, Structure(s), Spectroscopic, and Redox Properties, and the Binding of Amine Guests, Protons, and Lanthanide Ions

(2013) Alex McSkimming et al.   Chemistry-An Asian Journal

Comparison of ancillary ligand effects between 2,2′-bipyridine and 2-(2′-pyridyl)phenyl in the linkage and bridging isomerism of 5-methyltetrazolato iridium(iii) and/or rhodium(iii) complexes

(2013) Asuka Takayama et al.   DALTON TRANSACTIONS

A Benchmark Ab Initio and DFT Study of the Structure and Binding of Methane in the σ–Alkane Complex CpRe(CO)2(CH4)

(2013) Bun Chan et al.   Journal of Chemical Theory and Computation

A Critical Test of the “Tunneling and Coupled Motion” Concept in Enzymatic Alcohol Oxidation

(2013) Daniel Roston et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Arene–Ruthenium(II) and −Iridium(III) Complexes with “Click”-Based Pyridyl-triazoles, Bis-triazoles, and Chelating Abnormal Carbenes: Applications in Catalytic Transfer Hydrogenation of Nitrobenzene

(2013) Stephan Hohloch et al.   ORGANOMETALLICS

Recent Trends in Biomimetic NADH Regeneration

(2013) Tommaso Quinto et al.   TOPICS IN CATALYSIS

Hydrogen-Transfer Catalysis with Cp*IrIII Complexes: The Influence of the Ancillary Ligands

(2013) Ulrich Hintermair et al.   ACS Catalysis

Benchmark Study of the Performance of Density Functional Theory for Bond Activations with (Ni,Pd)-Based Transition-Metal Catalysts

(2013) Marc Steinmetz et al.   ChemistryOpen

Redox-Active Ligands in Catalysis

(2012) Vijayendran K. K. Praneeth et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Bridgehead Hydrogen Atoms Are Important: Unusual Electrochemistry and Proton Reduction at Iron Dimers with Ferrocenyl-Substituted Phosphido Bridges

(2012) Carolina Gimbert-Suriñach et al.   ORGANOMETALLICS

Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes

(2012) Katherine Gray et al.   ORGANOMETALLICS

Calculation of thermodynamic hydricities and the design of hydride donors for CO2 reduction

(2012) J. T. Muckerman et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Evolution in the understanding of [Fe]-hydrogenase

(2011) Michael J. Corr et al.   CHEMICAL SOCIETY REVIEWS

Enantioselective Synthesis of Amines: General, Efficient Iron-Catalyzed Asymmetric Transfer Hydrogenation of Imines

(2010) Shaolin Zhou et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Biocatalytic Redox Reactions for Organic Synthesis: Nonconventional Regeneration Methods

(2010) Frank Hollmann et al.   ChemCatChem

1,10-Phenanthroline: A versatile building block for the construction of ligands for various purposes

(2010) Andrea Bencini et al.   COORDINATION CHEMISTRY REVIEWS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Computational Thermochemistry: Scale Factor Databases and Scale Factors for Vibrational Frequencies Obtained from Electronic Model Chemistries

(2010) I. M. Alecu et al.   Journal of Chemical Theory and Computation

Thermodynamic Diagnosis of the Properties and Mechanism of Dihydropyridine-Type Compounds as Hydride Source in Acetonitrile with “Molecule ID Card”

(2010) Xiao-Qing Zhu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Multifunctional ligands in transition metal catalysis

(2010) Robert H. Crabtree   NEW JOURNAL OF CHEMISTRY

Elusive transition state of alcohol dehydrogenase unveiled

(2010) D. Roston et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Structural and Functional Analogues of the Active Sites of the [Fe]-, [NiFe]-, and [FeFe]-Hydrogenases†

(2009) Cédric Tard et al.   CHEMICAL REVIEWS

Asymmetric hydrogenation, transfer hydrogenation and hydrosilylation of ketones catalyzed by iron complexes

(2009) Robert H. Morris   CHEMICAL SOCIETY REVIEWS

Solid-State Structures and Solution Analyses of a PhenylpropylpyridineN-Oxide and anN-Methyl Phenylpropylpyridine

(2008) Isabella Richter et al.   Chemistry-An Asian Journal

Synthesis and antitumour evaluation of novel 2-phenylbenzimidazoles

(2008) Hachemi Kadri et al.   JOURNAL OF ENZYME INHIBITION AND MEDICINAL CHEMISTRY

Hydride, Hydrogen Atom, Proton, and Electron Transfer Driving Forces of Various Five-Membered Heterocyclic Organic Hydrides and Their Reaction Intermediates in Acetonitrile

(2008) Xiao-Qing Zhu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The Crystal Structure of [Fe]-Hydrogenase Reveals the Geometry of the Active Site

(2008) S. Shima et al.   SCIENCE