Formation of Pentadienal Complexes upon Protonation of Molybdenum (1-Alkylcyclopropyl)carbynes. Electronic Effects on Reductive Elimination versus .beta.-Hydrogen Elimination in Metallacyclohexenones

1994 ◽  
Vol 116 (19) ◽  
pp. 8629-8637 ◽  
Author(s):  
Mark D. Mortimer ◽  
John D. Carter ◽  
Kevin B. Kingsbury ◽  
Khalil A. Abboud ◽  
Lisa McElwee-White
2018 ◽  
Vol 37 (14) ◽  
pp. 2305-2318 ◽  
Author(s):  
Amanda C. Zimmerman ◽  
Michael D. Fryzuk

2018 ◽  
Vol 47 (8) ◽  
pp. 2662-2669 ◽  
Author(s):  
H.-L. Qin ◽  
J. Leng ◽  
W. Zhang ◽  
E. A. B. Kantchev

DFT calculations confirmed that the rearrangement of a PCP-Rh-H pincer to a CCP-Rh-phosphane pincer occured by C–P oxidative addition (ΔG‡ = 29.5 kcal mol−1, rate-determining step), followed by P–H reductive elimination (ΔG‡ = 4.8 kcal mol−1).


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