Viable pathways for the oxidative addition of iodobenzene to palladium(0)-triphenylphosphine-carbonyl complexes: a theoretical study.

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Viable pathways for the oxidative addition of iodobenzene to palladium(0)-triphenylphosphine-carbonyl complexes: a theoretical study.

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Viable pathways for the oxidative addition of iodobenzene to palladium

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Viable pathways for the oxidat ...... omplexes: a theoretical study.

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Viable pathways for the oxidative addition of iodobenzene to palladium

@nl

Viable pathways for the oxidat ...... omplexes: a theoretical study.

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Viable pathways for the oxidative addition of iodobenzene to palladium

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Viable pathways for the oxidat ...... omplexes: a theoretical study.

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P1476

Viable pathways for the oxidat ...... omplexes: a theoretical study.

@en

P2093

László Kollár

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Noémi Pálinkás

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Tamás Kégl

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P2860

A new local density functional for main-group thermochemistry, transition metal bonding, thermochemical kinetics, and noncovalent interactions

Accurate description of van der Waals complexes by density functional theory including empirical corrections.

NCIPLOT: a program for plotting non-covalent interaction regions.

Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensions.

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

Large-scale applications of transition metal-catalyzed couplings for the synthesis of pharmaceuticals.

Palladium-catalyzed carbonylative coupling reactions between Ar-X and carbon nucleophiles.

Synthesis of heterocycles via palladium-catalyzed carbonylations.

Organometallic reactivity: the role of metal-ligand bond energies from a computational perspective.

Effect of ligand steric properties and halide identity on the mechanism for oxidative addition of haloarenes to trialkylphosphine Pd(0) complexes.

P304

15789-15802

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P31

scholarly article

P356

10.1039/C7DT03642F

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P407

English

P433

http://www.w3.org/2001/XMLSchema#string

P478

http://www.w3.org/2001/XMLSchema#string

P577

2017-11-03T00:00:00Z

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P698

29098208

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