Theoretical Study of the Mechanism of Alkane Hydroxylation and Ethylene Epoxidation Reactions Catalyzed by Diiron Bis-oxo Complexes. The Effect of Substrate Molecules

2002 ◽  
Vol 124 (15) ◽  
pp. 4135-4148 ◽  
Author(s):  
Djamaladdin G. Musaev ◽  
Harold Basch ◽  
Keiji Morokuma
Keyword(s):  
Theoretical Study ◽  
Ethylene Epoxidation ◽  
Oxo Complexes ◽  
Alkane Hydroxylation

A theoretical study of the mechanisms of oxidation of ethylene by manganese oxo complexes

2013 ◽  
Vol 42 (40) ◽  
pp. 14411 ◽  
Author(s):  
Albert Aniagyei ◽  
Richard Tia ◽  
Evans Adei
Keyword(s):  
Theoretical Study ◽  
Oxo Complexes

Re- and Cs-Copromoted Silver Catalysts for Ethylene Epoxidation: A Theoretical Study

2019 ◽  
Vol 60 (11) ◽  
pp. 1713-1724 ◽  
Author(s):  
M. A. Salaev ◽  
A. A. Salaeva ◽  
O. Kh. Poleschuk ◽  
O. V. Vodyankina
Keyword(s):  
Theoretical Study ◽  
Ethylene Epoxidation ◽  
Silver Catalysts

Analysis of Reaction Channels for Alkane Hydroxylation by Nonheme Iron(IV)-Oxo Complexes

2010 ◽  
Vol 122 (33) ◽  
pp. 5853-5856 ◽  
Author(s):  
Caiyun Geng ◽  
Shengfa Ye ◽  
Frank Neese
Keyword(s):  
Nonheme Iron ◽  
Oxo Complexes ◽  
Alkane Hydroxylation ◽  
Reaction Channels

Combined Experimental and Theoretical Study on Aromatic Hydroxylation by Mononuclear Nonheme Iron(IV)−Oxo Complexes

2007 ◽  
Vol 46 (11) ◽  
pp. 4632-4641 ◽  
Author(s):  
Sam P. de Visser ◽  
Kyungeun Oh ◽  
Ah-Rim Han ◽  
Wonwoo Nam
Keyword(s):  
Theoretical Study ◽  
Nonheme Iron ◽  
Oxo Complexes ◽  
Aromatic Hydroxylation
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