Comparative Properties of Transition Metal Catalysts Inferred from Activation Energies of Elementary Steps of Catalytic Reactions

2000 ◽  
Vol 104 (5) ◽  
pp. 997-1008 ◽  
Author(s):  
Andrew V. Zeigarnik ◽  
Raúl E. Valdés-Pérez ◽  
Jérôme Pesenti
Keyword(s):  
Transition Metal ◽  
Activation Energies ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Catalytic Reactions ◽  
Elementary Steps

Cooperative Catalytic Reactions Using Organocatalysts and Transition Metal Catalysts: Enantioselective Propargylic Alkylation of Propargylic Esters with Aldehydes

2011 ◽  
Vol 13 (4) ◽  
pp. 592-595 ◽  
Author(s):  
Akiko Yoshida ◽  
Masahiro Ikeda ◽  
Gaku Hattori ◽  
Yoshihiro Miyake ◽  
Yoshiaki Nishibayashi
Keyword(s):  
Transition Metal ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Catalytic Reactions ◽  
Propargylic Esters

Towards more accurate prediction of activation energies for polyalcohol dehydrogenation on transition metal catalysts in water

2016 ◽  
Vol 6 (17) ◽  
pp. 6615-6624 ◽  
Author(s):  
Jérémie Zaffran ◽  
Carine Michel ◽  
Françoise Delbecq ◽  
Philippe Sautet
Keyword(s):  
Transition Metal ◽  
Catalytic Reaction ◽  
Reaction Network ◽  
Activation Energies ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Accurate Prediction ◽  
Reaction Intermediates ◽  
Activation Barriers ◽  
Reaction Energies

Polyols may be associated to a large catalytic reaction network. Brønsted–Evans–Polanyi (B.E.P.) relationships aim to easily predict activation barriers from reaction energies. Acting as a filter, such methods enable to quickly screen all the potential reaction intermediates and products.

Topological aspects of chemical reactivity. Catalytic reactions

1986 ◽  
Vol 51 (9) ◽  
pp. 1843-1855 ◽  
Author(s):  
Robert Ponec
Keyword(s):  
Transition Metal ◽  
Detailed Analysis ◽  
Chemical Reactivity ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Catalytic Reactions ◽  
Pericyclic Reactions

Recently proposed overlap determinant method is applied to the description of reactions induced by the presence of the transition metal catalysts. The use of this technique is demonstrated on a detailed analysis of a number of examples of thermally forbidden pericyclic reactions in which the interaction with the catalyst removes the symmetry restrictions imposed by Woodward-Hoffmann rules.

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