4.6 Article

The Transmetalation Process in Suzuki-Miyaura Reactions: Calculations Indicate Lower Barrier via Boronate Intermediate

Related references

Note: Only part of the references are listed.
Article Chemistry, Multidisciplinary

Palladium monophosphine Pd(PPh3): is it really accessible in solution?

Pietro Vidossich et al.

CHEMICAL COMMUNICATIONS (2014)

Review Chemistry, Multidisciplinary

Selection of boron reagents for Suzuki-Miyaura coupling

Alastair J. J. Lennox et al.

CHEMICAL SOCIETY REVIEWS (2014)

Review Chemistry, Multidisciplinary

Computational Perspective on Pd-Catalyzed C-C Cross-Coupling Reaction Mechanisms

Max Garcia-Melchor et al.

ACCOUNTS OF CHEMICAL RESEARCH (2013)

Review Chemistry, Multidisciplinary

Transmetalation in the Suzuki-Miyaura Coupling: The Fork in the Trail

Alastair J. J. Lennox et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2013)

Article Chemistry, Multidisciplinary

Understanding palladium complexes structures and reactivities: beyond classical point of view

Etienne Derat et al.

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2013)

Article Chemistry, Multidisciplinary

The Triple Role of Fluoride Ions in Palladium-Catalyzed Suzuki-Miyaura Reactions: Unprecedented Transmetalation from [ArPdFL2] Complexes

Christian Amatore et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2012)

Review Chemistry, Multidisciplinary

Palladium-Catalyzed Cross-Coupling: A Historical Contextual Perspective to the 2010 Nobel Prize

Carin C. C. Johansson Seechurn et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2012)

Article Chemistry, Physical

Microsolvated transition state models for improved insight into chemical properties and reaction mechanisms

Raghavan B. Sunoj et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)

Article Chemistry, Multidisciplinary

Transition metal catalysis by density functional theory and density functional theory/molecular mechanics

W. M. C. Sameera et al.

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2012)

Article Chemistry, Multidisciplinary

Dispersion and Back-Donation Gives Tetracoordinate [Pd(PPh3)4]

Marten S. G. Ahlquist et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2011)

Article Chemistry, Multidisciplinary

Solvent Effect on Palladium-Catalyzed Cross-Coupling Reactions and Implications on the Active Catalytic Species

Fabien Proutiere et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2011)

Review Chemistry, Multidisciplinary

Cross-Coupling Reactions Of Organoboranes: An Easy Way To Construct C-C Bonds (Nobel Lecture)

Akira Suzuki

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2011)

Article Chemistry, Physical

Applications and validations of the Minnesota density functionals

Yan Zhao et al.

CHEMICAL PHYSICS LETTERS (2011)

Article Chemistry, Inorganic & Nuclear

Phosphine and solvent effects on oxidative addition of CH3Br to Pd(PR3) and Pd(PR3)(2) complexes

Maria Besora et al.

DALTON TRANSACTIONS (2011)

Article Chemistry, Multidisciplinary

Distinguishing Between Pathways for Transmetalation in Suzuki-Miyaura Reactions

Brad P. Carrow et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)

Letter Chemistry, Multidisciplinary

Role of a base in Suzuki-Miyaura reaction

A. F. Schmidt et al.

RUSSIAN JOURNAL OF GENERAL CHEMISTRY (2011)

Review Chemistry, Multidisciplinary

Theoretical aspects of palladium-catalysed carbon-carbon cross-coupling reactions

Liqin Xue et al.

CHEMICAL SOCIETY REVIEWS (2010)

Article Chemistry, Inorganic & Nuclear

Accurate modelling of Pd(0) + PhX oxidative addition kinetics

Claire L. McMullin et al.

DALTON TRANSACTIONS (2010)

Article Chemistry, Physical

Integration Grid Errors for Meta-GGA-Predicted Reaction Energies: Origin of Grid Errors for the M06 Suite of Functionals

Steven E. Wheeler et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2010)

Article Chemistry, Physical

A computational study of phosphine ligand effects in Suzuki-Miyaura coupling

Jesus Jover et al.

JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL (2010)

Article Chemistry, Multidisciplinary

Ligand-Controlled Regioselectivity in Palladium-Catalyzed Cross Coupling Reactions

Franziska Schoenebeck et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)

Article Chemistry, Multidisciplinary

Ligandless, Anionic, Arylpalladium Halide Intermediates in the Heck Reaction

Brad P. Carrow et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)

Article Chemistry, Inorganic & Nuclear

Noncovalent Interactions in a Transition-Metal Triphenylphosphine Complex: a Density Functional Case Study

Nicolas Sieffert et al.

INORGANIC CHEMISTRY (2009)

Article Chemistry, Multidisciplinary

C-C Reductive Elimination in Palladium Complexes, and the Role of Coupling Additives. A DFT Study Supported by Experiment

Martin Perez-Rodriguez et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)

Review Chemistry, Multidisciplinary

Density functionals with broad applicability in chemistry

Yan Zhao et al.

ACCOUNTS OF CHEMICAL RESEARCH (2008)

Article Chemistry, Inorganic & Nuclear

Oxidative addition of aryl chlorides to monoligated palladium(0): A DFT-SCRF study

Marten Ahlquist et al.

ORGANOMETALLICS (2007)

Article Chemistry, Multidisciplinary

Pd-catalyzed Suzuki cross-coupling reaction of bromostilbene: Insights on the nature of the boron species

Carolina M. Nunes et al.

JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY (2007)

Article Chemistry, Inorganic & Nuclear

Computational study of the transmetalation process in the Suzuki-Miyaura cross-coupling of aryls

Ataualpa A. C. Braga et al.

JOURNAL OF ORGANOMETALLIC CHEMISTRY (2006)

Article Chemistry, Inorganic & Nuclear

A DFT study of the full catalytic cycle of the Suzuki-Miyaura cross-coupling on a model system

Ataualpa A. C. Braga et al.

ORGANOMETALLICS (2006)

Article Chemistry, Inorganic & Nuclear

Palladium monophosphine intermediates in catalytic cross-coupling reactions: A DFT study

LJ Goossen et al.

ORGANOMETALLICS (2006)

Article Chemistry, Multidisciplinary

The palladium-catalyzed cross-coupling reaction of carboxylic anhydrides with arylboronic acids: A DFT study

LJ Goossen et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)

Article Chemistry, Inorganic & Nuclear

Reductive elimination of organic molecules from palladium-diphosphine complexes

E Zuidema et al.

ORGANOMETALLICS (2005)

Article Chemistry, Multidisciplinary

Computational characterization of the role of the base in the Suzuki-Miyaura cross-coupling reaction

AAC Braga et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)

Article Chemistry, Inorganic & Nuclear

Mechanistic pathways for oxidative addition of aryl halides to palladium(0) complexes: A DFT study

LJ Goossen et al.

ORGANOMETALLICS (2005)

Review Chemistry, Multidisciplinary

Palladium-catalyzed cross-coupling reactions in total synthesis

KC Nicolaou et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2005)

Review Chemistry, Multidisciplinary

Theoretical study of trans-metalation process in palladium-catalyzed borylation of iodobenzene with diboron

M Sumimoto et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)

Article Chemistry, Inorganic & Nuclear

Cross-coupling reaction of organoboron compounds via base-assisted transmetalation to palladium(II) complexes

N Miyaura

JOURNAL OF ORGANOMETALLIC CHEMISTRY (2002)

Review Chemistry, Multidisciplinary

Vinyl-vinyl coupling on late transition metals through C-C reductive elimination mechanism. A computational study

VP Ananikov et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2002)