Relative stabilities of M/NHC complexes (M = Ni, Pd, Pt) against R–NHC, X–NHC and X–X couplings in M(0)/M(ii) and M(ii)/M(iv) catalytic cycles: a theoretical study-Reference-Cited by-同舟云学术

Relative stabilities of M/NHC complexes (M = Ni, Pd, Pt) against R–NHC, X–NHC and X–X couplings in M(0)/M(ii) and M(ii)/M(iv) catalytic cycles: a theoretical study

Published:2019 Issue:45 Volume:48 Page:17052-17062
ISSN:1477-9226
Container-title:Dalton Transactions
language:en
Short-container-title:Dalton Trans.

Author:

Astakhov Alexander V.¹²³⁴⁵^ORCID,Soliev Safarmurod B.¹²³,Gordeev Evgeniy G.⁴⁵⁶³^ORCID,Chernyshev Victor M.¹²³⁴⁵^ORCID,Ananikov Valentine P.¹²³⁴⁵^ORCID

Affiliation:

1. Platov South-Russian State Polytechnic University (NPI)

2. Novocherkassk

3. Russia

4. Zelinsky Institute of Organic Chemistry

5. Russian Academy of Sciences

6. Moscow

Abstract

DFT calculations reveal relative stability of M^II/NHC and M^IV/NHC complexes of nickel, palladium and platinum against the R–NHC coupling and various reductive elimination reactions that influence catalyst stability/decomposition.

Funder

Russian Science Foundation

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2019/DT/C9DT03266E

Reference112 articles.

1. N-Heterocyclic Carbenes: A New Concept in Organometallic Catalysis

2. N-Heterocyclic Carbenes in Late Transition Metal Catalysis

3. N-Heterocyclic carbene (NHC) ligands and palladium in homogeneous cross-coupling catalysis: a perfect union