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There are 88277 results for: content related to: A Theoretical Study of Hydrogen Transfer Catalyzed by an Ir III PC(sp 3 )P Pincer Complex

  1. Ruthenium Pincer Complexes: Synthesis and Catalytic Applications

    Advanced Synthesis & Catalysis

    Volume 357, Issue 2-3, February 9, 2015, Pages: 283–330, Hussein A. Younus, Wei Su, Nazir Ahmad, Si Chen and Francis Verpoort

    Article first published online : 29 JAN 2015, DOI: 10.1002/adsc.201400777

  2. Hydride Ligands Make the Difference: Density Functional Study of the Mechanism of the Murai Reaction Catalyzed by [Ru(H)2(H2)2(PR3)2] (R=cyclohexyl)

    Chemistry - A European Journal

    Volume 18, Issue 36, September 3, 2012, Pages: 11449–11458, Dr. Ulrike Helmstedt and Dr. Eric Clot

    Article first published online : 30 JUL 2012, DOI: 10.1002/chem.201200757

  3. Low Activation Barriers in N2 Reduction with H2 at Ruthenium Pincer Complexes Induced by Ligand Cooperativity: A Computational Study

    European Journal of Inorganic Chemistry

    Volume 2014, Issue 35, December 2014, Pages: 6126–6133, Markus Hölscher and Walter Leitner

    Article first published online : 7 NOV 2014, DOI: 10.1002/ejic.201402706

  4. Analysis of Potential Molecular Catalysts for the Hydroamination of Ethylene with Ammonia: A DFT Study with [Ir(PCP)] and [Ir(PSiP)] Complexes

    Chemistry - A European Journal

    Volume 19, Issue 3, January 14, 2013, Pages: 1020–1027, Andreas Uhe, Dr. Markus Hölscher and Prof. Dr. Walter Leitner

    Article first published online : 26 NOV 2012, DOI: 10.1002/chem.201202185

  5. Carboxylation of Arene C[BOND]H Bonds with CO2: A DFT-Based Approach to Catalyst Design

    Chemistry - A European Journal

    Volume 18, Issue 1, January 2, 2012, Pages: 170–177, Dipl.-Chem. Andreas Uhe, Dr. Markus Hölscher and Prof. Dr. Walter Leitner

    Article first published online : 5 DEC 2011, DOI: 10.1002/chem.201102785

  6. Mechanistic Investigation of the Ruthenium–N-Heterocyclic-Carbene-Catalyzed Amidation of Amines with Alcohols

    Chemistry - A European Journal

    Volume 18, Issue 49, December 3, 2012, Pages: 15683–15692, Ilya S. Makarov, Dr. Peter Fristrup and Prof. Dr. Robert Madsen

    Article first published online : 15 OCT 2012, DOI: 10.1002/chem.201202400

  7. Alkene Isomerisation Catalysed by a Ruthenium PNN Pincer Complex

    Chemistry - A European Journal

    Volume 20, Issue 47, November 17, 2014, Pages: 15434–15442, Sébastien Perdriau, Mu-Chieh Chang, Dr. Edwin Otten, Prof. Dr. Hero J. Heeres and Prof. Dr. Johannes G. de Vries

    Article first published online : 26 SEP 2014, DOI: 10.1002/chem.201403236

  8. Enantioselective Arylation of N-Tosylimines by Phenylboronic Acid Catalysed by a Rhodium/Diene Complex: Reaction Mechanism from Density Functional Theory

    Chemistry - A European Journal

    Volume 21, Issue 27, June 26, 2015, Pages: 9753–9768, Dr. Nicolas Sieffert, Dr. Julien Boisson and Dr. Sandrine Py

    Article first published online : 1 JUN 2015, DOI: 10.1002/chem.201500587

  9. Thermodynamics and Kinetics of the Hydride-Transfer Cycles for 1-Aryl-1,4-dihydronicotinamide and Its 1,2-Dihydroisomer

    Chemistry - A European Journal

    Volume 9, Issue 16, August 18, 2003, Pages: 3937–3945, Xiao-Qing Zhu, Lei Cao, Yang Liu, Yuan Yang, Jin-Yong Lu, Jian-Shuang Wang and Jin-Pei Cheng

    Article first published online : 7 AUG 2003, DOI: 10.1002/chem.200304714

  10. How Can Theory Predict the Selectivity of Palladium-Catalyzed Cross-Coupling of Pristine Aromatic Molecules?

    Chemistry - A European Journal

    Volume 17, Issue 27, June 27, 2011, Pages: 7623–7631, Rinat Meir, Dr. Sebastian Kozuch, Andreas Uhe and Prof. Sason Shaik

    Article first published online : 18 MAY 2011, DOI: 10.1002/chem.201002724

  11. On the Importance of Decarbonylation as a Side-Reaction in the Ruthenium-Catalysed Dehydrogenation of Alcohols: A Combined Experimental and Density Functional Study

    Chemistry - A European Journal

    Volume 20, Issue 14, April 1, 2014, Pages: 4141–4155, Dr. Nicolas Sieffert, Romain Réocreux, Patrizia Lorusso, Prof. Dr. David J. Cole-Hamilton and Prof. Dr. Michael Bühl

    Article first published online : 5 MAR 2014, DOI: 10.1002/chem.201303722

  12. Anionic d8 Alkyl Hydrides – Selective Formation and Reactivity of Anionic cis-PtII Methyl Hydride

    European Journal of Inorganic Chemistry

    Volume 2010, Issue 13, May 2010, Pages: 1991–1999, Elena Poverenov, Mark A. Iron, Mark Gandelman, Yehoshoa Ben-David and David Milstein

    Article first published online : 26 MAR 2010, DOI: 10.1002/ejic.201000052

  13. Characterization of a Palladium Dihydrogen Complex

    Angewandte Chemie International Edition

    Volume 54, Issue 20, May 11, 2015, Pages: 5915–5918, Samantha J. Connelly, Andrew G. Chanez, Prof. Werner Kaminsky and Prof. D. Michael Heinekey

    Article first published online : 17 MAR 2015, DOI: 10.1002/anie.201412076

  14. In Silico Design of Heteroaromatic Half-Sandwich RhI Catalysts for Acetylene [2+2+2] Cyclotrimerization: Evidence of a Reverse Indenyl Effect

    Chemistry - A European Journal

    Volume 19, Issue 40, September 27, 2013, Pages: 13337–13347, Dr. Laura Orian, Lando P. Wolters and Prof. Dr. F. Matthias Bickelhaupt

    Article first published online : 3 SEP 2013, DOI: 10.1002/chem.201301990

  15. Silyl Ligand Mediated Reversible β-Hydrogen Elimination and Hydrometalation at Palladium

    Chemistry - A European Journal

    Volume 20, Issue 37, September 8, 2014, Pages: 11812–11819, Dr. Jun Takaya and Prof. Dr. Nobuharu Iwasawa

    Article first published online : 30 JUL 2014, DOI: 10.1002/chem.201403220

  16. Iron Borohydride Pincer Complexes for the Efficient Hydrogenation of Ketones under Mild, Base-Free Conditions: Synthesis and Mechanistic Insight

    Chemistry - A European Journal

    Volume 18, Issue 23, June 4, 2012, Pages: 7196–7209, Dr. Robert Langer, Dr. Mark A. Iron, Dr. Leonid Konstantinovski, Dr. Yael Diskin-Posner, Dr. Gregory Leitus, Yehoshoa Ben-David and Prof. Dr. David Milstein

    Article first published online : 24 APR 2012, DOI: 10.1002/chem.201200159

  17. β-Hydrogen Elimination Reactions of Nickel and Palladium Methoxides Stabilised by PCP Pincer Ligands

    Chemistry - A European Journal

    Volume 21, Issue 27, June 26, 2015, Pages: 9833–9849, Dr. Luis M. Martínez-Prieto, Elena Ávila, Dr. Pilar Palma, Dr. Eleuterio Álvarez and Prof. Dr. Juan Cámpora

    Article first published online : 28 MAY 2015, DOI: 10.1002/chem.201500652

  18. Bifunctional (Cyclopentadienone)Iron–Tricarbonyl Complexes: Synthesis, Computational Studies and Application in Reductive Amination

    Chemistry - A European Journal

    Volume 19, Issue 52, December 23, 2013, Pages: 17881–17890, Dr. Solenne Moulin, Dr. Hélène Dentel, Dr. Anastassiya Pagnoux-Ozherelyeva, Dr. Sylvain Gaillard, Dr. Albert Poater, Prof. Dr. Luigi Cavallo, Jean-François Lohier and Prof. Dr. Jean-Luc Renaud

    Article first published online : 15 NOV 2013, DOI: 10.1002/chem.201302432

  19. Reduction of Metal Coordinated N2 to NH3 with H2 by Heterolytic Hydrogen Cleavage induced by External Lewis Bases – a DFT Study

    Zeitschrift für anorganische und allgemeine Chemie

    Volume 641, Issue 1, January 2015, Pages: 72–77, Markus Hölscher and Walter Leitner

    Article first published online : 6 OCT 2014, DOI: 10.1002/zaac.201400337

  20. Catalytic Co-Homologation of Alkanes and Dimethyl Ether and Promotion by Adamantane as a Hydride Transfer Co-Catalyst

    ChemCatChem

    Volume 3, Issue 4, April 11, 2011, Pages: 704–718, Prof. Dante A. Simonetti, John H. Ahn and Dr. Enrique Iglesia

    Article first published online : 15 FEB 2011, DOI: 10.1002/cctc.201000383