Coordination− insertion copolymerization of fundamental polar monomers

A Nakamura, S Ito, K Nozaki - Chemical reviews, 2009 - ACS Publications
Akifumi Nakamura (left) was born in 1984 in Kanagawa, Japan. He received his BS degree
in 2007 and MS degree in 2009 from the University of Tokyo under the guidance of …

Theoretical studies on reactions of transition-metal complexes

S Niu, MB Hall - Chemical reviews, 2000 - ACS Publications
Stoichiometric and catalytic transition-metal reactions have attracted great interest for their
many applications in industrial and synthetic processes. Transition-metal reactions are …

Alternating copolymerization of carbon monoxide and olefins by single-site metal catalysis

C Bianchini, A Meli - Coordination chemistry reviews, 2002 - Elsevier
The alternating copolymerization of carbon monoxide and olefins is a reaction that transition
metal complexes, generally containing palladium, catalyze in different phase variation …

The role of bulky substituents in Brookhart-type Ni (II) diimine catalyzed olefin polymerization: a combined density functional theory and molecular mechanics study

L Deng, TK Woo, L Cavallo, PM Margl… - Journal of the American …, 1997 - ACS Publications
The role of the bulky ligands in Ni (II) diimine catalyzed ethylene polymerization has been
examined with a combined density functional theory quantum mechanics and molecular …

Theoretical studies in palladium and platinum molecular chemistry

A Dedieu - Chemical Reviews, 2000 - ACS Publications
The chemistry of palladium and platinum is one of the most extensive and versatile fields of
chemistry. This results from the fact that these two metals can very easily form adducts with …

Mechanism of ruthenium-catalyzed olefin metathesis reactions from a theoretical perspective

L Cavallo - Journal of the American Chemical Society, 2002 - ACS Publications
This paper presents a density functional theory study of the ruthenium-catalyzed olefin
metathesis reactions. The ligand binding energy has been calculated in the first generation …

Mechanistic features of isomerizing alkoxycarbonylation of methyl oleate

P Roesle, CJ Dürr, HM Möller… - Journal of the …, 2012 - ACS Publications
The weakly coordinated triflate complex [(P∧ P) Pd (OTf)]+(OTf)−(1)(P∧ P= 1, 3-bis (di-tert-
butylphosphino) propane) is a suitable reactive precursor for mechanistic studies of the …

Mechanistic Aspects of the Alternating Copolymerization of Propene with Carbon Monoxide Catalyzed by Pd (II) Complexes of Unsymmetrical Phosphine− Phosphite …

K Nozaki, N Sato, Y Tonomura… - Journal of the …, 1997 - ACS Publications
The reaction steps responsible for the highly enantioselective asymmetric copolymerization
of propene with carbon monoxide catalyzed by a cationic Pd (II) complex bearing an …

Mechanistic Aspects of Ethylene Polymerization by Iron (II)− Bisimine Pyridine Catalysts: A Combined Density Functional Theory and Molecular Mechanics Study

L Deng, P Margl, T Ziegler - Journal of the American Chemical …, 1999 - ACS Publications
We present an extensive theoretical study of the iron (II)− bisimine pyridine based ethylene-
polymerization catalysts {[2, 6-((R) NC (R ')) 2− C5H3N] FeC3H7}+(R= R '= H, 1a; R= 2, 6 …

Geometry and Stability of Titanium Chloride Species Adsorbed on the (100) and (110) Cuts of the MgCl2 Support of the Heterogeneous Ziegler−Natta Catalysts

G Monaco, M Toto, G Guerra, P Corradini… - …, 2000 - ACS Publications
Possible structures of TiCl4 molecules and TiCl3 fragments adsorbed on (110) and (100)
faces of MgCl2, simulated by clusters of different size and shape, have been studied in the …