Browsing Research Output by Subject "1-Octene"
Now showing items 1-3 of 3
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Experimental and DFT investigation of the 1-octene metathesis reaction mechanism with the Grubbs 1 precatalyst
(Elsevier, 2006)Using density functional theory the metathesis reactions of 1-octene in the presence of Grubbs 1 [RuCl2(PCy3)2( CHPh)] is investigated. At the GGA-PW91/DNP level, the complete geometry optimization and the activation ... -
Experimental, DFT and kinetic study of 1-octene metathesis with Hoveyda-Grubbs second generation precatalyst
(Elsevier, 2012)In this study we report the catalytic performance, reaction engineering kinetics and elucidation of the reaction mechanism using density functional theory (DFT) for the metathesis reaction of 1-octene in the presence of ... -
Synthesis and application of novel ruthenium catalysts for high temperature alkene metathesis
(MDPI, 2017)Four pyridinyl alcohols and the corresponding hemilabile pyridinyl alcoholato ruthenium carbene complexes of the Grubbs second generation-type RuCl(H2IMes)(O^N)(=CHPh), where O^N = 1-(2′-pyridinyl)-1,1-diphenyl methanolato, ...