(Q38206709)

31 August 2017

title

Experiment and computation: a combined approach to study the reactivity of palladium complexes in oxidation states 0 to IV. (English)

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31 August 2017

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Franziska Schoenebeck

series ordinal

2

object named as

Franziska Schoenebeck

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Karl J Bonney

object named as

Karl J Bonney

series ordinal

1

0 references

publication date

1 September 2014

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31 August 2017

published in

Chemical Society Reviews

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31 August 2017

volume

43

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31 August 2017

issue

18

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31 August 2017

page(s)

6609-6638

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Discovery of an α-amino C-H arylation reaction using the strategy of accelerated serendipity

31 August 2017

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Selective carbon-carbon bond formation by cross-coupling of Grignard reagents with organic halides. Catalysis by nickel-phosphine complexes

21 January 2018

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Development of Pd–Cu catalyzed cross-coupling of terminal acetylenes with sp2-carbon halides

21 January 2018

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Recent advances in Sonogashira reactions

21 January 2018

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A guide to Sonogashira cross-coupling reactions: the influence of substituents in aryl bromides, acetylenes, and phosphines.

21 January 2018

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The Sonogashira reaction: a booming methodology in synthetic organic chemistry.

21 January 2018

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Mechanistic Pathways for Oxidative Addition of Aryl Halides to Palladium(0) Complexes: A DFT Study

21 January 2018

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The mechanism of the oxidative addition of aryl halides to Pd-catalysts: a DFT investigation

21 January 2018

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Versatile Catalysts for the Suzuki Cross-Coupling of Arylboronic Acids with Aryl and Vinyl Halides and Triflates under Mild Conditions

21 January 2018

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Synthesis, characterization, and reactivity of monomeric, arylpalladium halide complexes with a hindered phosphine as the only dative ligand

21 January 2018

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Synthesis, structure, theoretical studies, and Ligand exchange reactions of monomeric, T-shaped arylpalladium(II) halide complexes with an additional, weak agostic interaction

21 January 2018

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The first general method for palladium-catalyzed Negishi cross-coupling of aryl and vinyl chlorides: use of commercially available Pd(P(t-Bu)(3))(2) as a catalyst.

21 January 2018

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Ligand-controlled regioselectivity in palladium-catalyzed cross coupling reactions

21 January 2018

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Solvent effect on palladium-catalyzed cross-coupling reactions and implications on the active catalytic species

21 January 2018

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Rates and mechanism of the reversible oxidative addition of (Z)- and (E)-1,2-dichloroethylene to low-ligated zerovalent palladium

21 January 2018

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Anionic Pd(0) and Pd(II) Intermediates in Palladium-Catalyzed Heck and Cross-Coupling Reactions

21 January 2018

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Formation of anionic palladium(0) complexes ligated by the trifluoroacetate ion and their reactivity in oxidative addition

21 January 2018

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A combined kinetic-quantum mechanical model for assessment of catalytic cycles: application to cross-coupling and Heck reactions.

21 January 2018

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Active anionic zero-valent palladium catalysts: characterization by density functional calculations

21 January 2018

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Palladium Monophosphine Intermediates in Catalytic Cross-Coupling Reactions: A DFT Study

21 January 2018

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

21 January 2018

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Reactivity and stability of dinuclear Pd(I) complexes: studies on the active catalytic species, insights into precatalyst activation and deactivation, and application in highly selective cross-coupling reactions

21 January 2018

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Unparalleled Rates for the Activation of Aryl Chlorides and Bromides: Coupling with Amines and Boronic Acids in Minutes at Room Temperature

21 January 2018

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Palladium-catalyzed amination of aryl bromides with hindered N-alkyl-substituted anilines using a palladium(I) tri-tert-butylphosphine bromide dimer

21 January 2018

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Scope and mechanism of palladium-catalyzed amination of five-membered heterocyclic halides

21 January 2018

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Bimetallic catalysis involving dipalladium(I) and diruthenium(I) complexes.

21 January 2018

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Suzuki-Miyaura cross-coupling of unprotected, nitrogen-rich heterocycles: substrate scope and mechanistic investigation

21 January 2018

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Competitive and selective Csp3-Br versus Csp2-Br bond activation in palladium-catalysed Suzuki cross-coupling: an experimental and theoretical study of the role of phosphine ligands

21 January 2018

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Palladium(0)-catalyzed intermolecular amination of unactivated C(sp³)-H bonds

21 January 2018

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Intramolecular palladium-catalyzed alkane C-H arylation from aryl chlorides

21 January 2018

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Activation of an alkyl C-H bond geminal to an agostic interaction: an unusual mode of base-induced C-H activation

21 January 2018

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DFT study of the mechanism of benzocyclobutene formation by palladium-catalysed C(sp3)-H activation: role of the nature of the base and the phosphine

21 January 2018

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Agostic interactions in transition metal compounds

21 January 2018

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Synthesis of benzocyclobutenes by palladium-catalyzed C-H activation of methyl groups: method and mechanistic study

21 January 2018

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Tridentate assembling ligands based on oxazoline and phosphorus donors in dinuclear Pd(I)-Pd(I) complexes

21 January 2018

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Synthetic and mechanistic studies of Pd-catalyzed C-H arylation with diaryliodonium salts: evidence for a bimetallic high oxidation state Pd intermediate

21 January 2018

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Synthesis and X-ray structure determination of highly active Pd(II), Pd(I), and Pd(0) complexes of di(tert-butyl)neopentylphosphine (DTBNpP) in the arylation of amines and ketones

21 January 2018

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Bimetallic catalysis using transition and Group 11 metals: an emerging tool for C-C coupling and other reactions

21 January 2018

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Metal-catalysed halogen exchange reactions of aryl halides

21 January 2018

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Nickel-catalysed aromatic Finkelstein reaction of aryl and heteroaryl bromides

21 January 2018

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Radicals in transition metal catalyzed reactions? transition metal catalyzed radical reactions?: a fruitful interplay anyway: part 3: catalysis by group 10 and 11 elements and bimetallic catalysis

21 January 2018

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High-valent organometallic copper and palladium in catalysis

21 January 2018

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Bystanding F+ oxidants enable selective reductive elimination from high-valent metal centers in catalysis

21 January 2018

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A highly selective catalytic method for the oxidative functionalization of C-H bonds

21 January 2018

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Oxidation of a cyclometalated Pd(II) dimer with "CF3+": formation and reactivity of a catalytically competent monomeric Pd(IV) aquo complex

21 January 2018

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Aryl-aryl bond formation by transition-metal-catalyzed direct arylation.

21 January 2018

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Palladium(II)-catalyzed C-H activation/C-C cross-coupling reactions: versatility and practicality

21 January 2018

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Organopalladium(IV) chemistry

21 January 2018

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Bimetallic palladium catalysis: direct observation of Pd(III)-Pd(III) intermediates

21 January 2018

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Bimetallic reductive elimination from dinuclear Pd(III) complexes

21 January 2018

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Binuclear intermediates in oxidation reactions: [(Me(3)SiC[triple bond]C)Me(2)(bipy)Pt-PtMe(2)(bipy)](+) in the oxidation of Pt(II)Me(2)(bipy) (bipy = 2,2'-bipyridine) by IPh(C[triple bond]CSiMe(3))(OTf) (OTf = triflate).

21 January 2018

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Searching for precursors to metal-metal bonded dipalladium species: a study of Pd2(4+) complexes.

21 January 2018

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

21 January 2018

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Semiempirical GGA-type density functional constructed with a long-range dispersion correction.

21 January 2018

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COSMO-RS: an alternative to simulation for calculating thermodynamic properties of liquid mixtures

21 January 2018

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Transmetalation in the Suzuki-Miyaura coupling: the fork in the trail.

21 January 2018

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Revealing a second transmetalation step in the Negishi coupling and its competition with reductive elimination: improvement in the interpretation of the mechanism of biaryl syntheses.

21 January 2018

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Subtle balance of ligand steric effects in Stille transmetalation.

21 January 2018

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Insights into the elementary steps in Negishi coupling through kinetic investigations.

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Kumada–Corriu coupling of Grignard reagents, probed with a chiral Grignard reagent

21 January 2018

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Developing ligands for palladium(II)-catalyzed C-H functionalization: intimate dialogue between ligand and substrate

21 January 2018

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Palladium-Catalyzed Ligand-Directed C−H Functionalization Reactions

21 January 2018

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Recent advances in the transition metal-catalyzed twofold oxidative C-H bond activation strategy for C-C and C-N bond formation

21 January 2018

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Transition-metal-catalyzed direct arylation of (hetero)arenes by C-H bond cleavage.

21 January 2018

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Propane activation by palladium complexes with chelating bis(NHC) ligands and aerobic cooxidation

21 January 2018

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Palladium Round Trip in the Negishi Coupling of trans-[PdMeCl(PMePh2)2] with ZnMeCl: An Experimental and DFT Study of the Transmetalation Step

21 January 2018

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Mechanism of the Stille Reaction. 2. Couplings of Aryl Triflates with Vinyltributyltin. Observation of Intermediates. A More Comprehensive Scheme

21 January 2018

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Mechanism of the Stille Reaction. 1. The Transmetalation Step. Coupling of R1I and R2SnBu3Catalyzed bytrans-[PdR1IL2] (R1= C6Cl2F3; R2= Vinyl, 4-Methoxyphenyl; L = AsPh3)

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

A theoretical DFT-based and experimental study of the transmetalation step in Au/Pd-mediated cross-coupling reactions.

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Stille coupling involving bulky groups feasible with gold cocatalyst

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Electronic effects on reductive elimination to form carbon-carbon and carbon-heteroatom bonds from palladium(II) complexes

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

C-C reductive elimination in palladium complexes, and the role of coupling additives. A DFT study supported by experiment

21 January 2018

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Transmetallation versus β-hydride elimination: the role of 1,4-benzoquinone in chelation-controlled arylation reactions with arylboronic acids

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Bite angle effects of diphosphines in C-C and C-X bond forming cross coupling reactions.

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Slow reductive elimination from arylpalladium parent amido complexes

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Reductive elimination from arylpalladium cyanide complexes

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Kinetic and density functional studies on alkyl-carbene elimination from Pd(II) heterocylic carbene complexes: a new type of reductive elimination with clear implications for catalysis

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Enantioselective synthesis of axially chiral biaryls by the Pd-catalyzed Suzuki-Miyaura reaction: substrate scope and quantum mechanical investigations

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Nucleophile-catalyzed, facile, and highly selective C-H activation of fluoroform with Pd(II).

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

N,N-Chelate-control on the regioselectivity in acetate-assisted C-H activation

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Proton abstraction mechanism for the palladium-catalyzed intramolecular arylation.

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Intramolecular C-H activation by alkylpalladium(II) complexes: insights into the mechanism of the palladium-catalyzed arylation reaction

21 January 2018

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Direct palladium-catalyzed C-2 and C-3 arylation of indoles: a mechanistic rationale for regioselectivity

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Understanding reactivity and stereoselectivity in palladium-catalyzed diastereoselective sp3 C-H bond activation: intermediate characterization and computational studies.

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Enantioselective and Diastereoselective Tsuji-Trost Allylic Alkylation of Lactones: An Experimental and Computational Study

21 January 2018

1 reference

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Origin of Selectivity of Tsuji-Trost Allylic Alkylation of Lactones: Highly Ordered Transition States with Lithium-Containing Enolates

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

The oxidative addition of lodomethane to [PdMe2(bpy)] and the X-ray structure of the organopalladium(IV) product fac-[PdMe3(bpy)l](bpy = 2,2′-bipyridyl)

21 January 2018

1 reference

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Unusually stable palladium(IV) complexes: detailed mechanistic investigation of C-O bond-forming reductive elimination

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Synthetic and computational studies of the palladium(IV) system Pd(alkyl)(aryl)(alkynyl)(bidentate)(triflate) exhibiting selectivity in C-C reductive elimination

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Mechanism of C-F reductive elimination from palladium(IV) fluorides

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

A fluoride-derived electrophilic late-stage fluorination reagent for PET imaging.

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Mechanistic and computational studies of oxidatively-induced aryl-CF3 bond-formation at Pd: rational design of room temperature aryl trifluoromethylation

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Combined experimental and theoretical study of the mechanism and enantioselectivity of palladium- catalyzed intermolecular Heck coupling.

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Oxidative Addition of Aryl Halides to Palladium(0) Complexes: A Density-Functional Study Including Solvation

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Mechanism of Pd-Catalyzed Ar–Ar Bond Formation Involving Ligand-Directed C–H Arylation and Diaryliodonium Oxidants: Computational Studies of Orthopalladation at Binuclear Pd(II) Centers, Oxidation To Form Binuclear Palladium(III) Species, and Ar?

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Connecting Binuclear Pd(III) and Mononuclear Pd(IV) Chemistry by Pd–Pd Bond Cleavage

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

On the role of anionic ligands in the site-selectivity of oxidative C–H functionalization reactions of arenes

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Controlling Site Selectivity in Pd-Catalyzed Oxidative Cross-Coupling Reactions

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Detailed Study of C−O and C−C Bond-Forming Reductive Elimination from Stable C2N2O2−Ligated Palladium(IV) Complexes

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Participation of Carbonyl Oxygen in Carbon–Carboxylate Bond-Forming Reductive Elimination from Palladium

21 January 2018

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https://api.crossref.org/works/10.1039%2FC4CS00061G

Carbon(sp3)Fluorine Bond-Forming Reductive Elimination from Palladium(IV) Complexes

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

What Makes for a Bad Catalytic Cycle? A Theoretical Study on the Suzuki−Miyaura Reaction within the Energetic Span Model

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC4CS00061G

Synthesis and X-ray Structural Characterization of Two Unbridged Diplatinum(III) Compounds: cis-andtrans-Bis[bis(1-imino-1-methoxyethane)trichloroplatinum(III)]. Transient Species in the Oxidation of Platinum(II) to Platinum(IV)

21 January 2018

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21 January 2018

Identifiers

DOI

10.1039/C4CS00061G

1 reference

31 August 2017

1 reference