The mechanism and regioselectivity of the ene reactions of nitroso compounds: a theoretical study of reactivity, regioselectivity, and kinetic isotope effects establishes a stepwise path involving polarized diradical intermediates

2003 ◽  
Vol 1 (8) ◽  
pp. 1389-1403 ◽  
Author(s):  
Andrew G. Leach ◽  
K. N. Houk
Keyword(s):  
Theoretical Study ◽  
Isotope Effects ◽  
Kinetic Isotope Effects ◽  
Nitroso Compounds ◽  
Ene Reactions ◽  
Kinetic Isotope

Experimental and Theoretical Study of the Carbon-13 and Deuterium Kinetic Isotope Effects in the Cl and OH Reactions of CH3F

2008 ◽  
Vol 112 (48) ◽  
pp. 12416-12429 ◽  
Author(s):  
Marina Marinkovic ◽  
Margret Gruber-Stadler ◽  
J. Michael Nicovich ◽  
Raenell Soller ◽  
Max Mülhäuser ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Isotope Effects ◽  
Kinetic Isotope Effects ◽  
Kinetic Isotope ◽  
Oh Reactions

scholarly journals Temperature Dependence of the Kinetic Isotope Effects in Thymidylate Synthase. A Theoretical Study

2011 ◽  
Vol 133 (17) ◽  
pp. 6692-6702 ◽  
Author(s):  
Natalia Kanaan ◽  
Silvia Ferrer ◽  
Sergio Martí ◽  
Mireia Garcia-Viloca ◽  
Amnon Kohen ◽  
...  
Keyword(s):  
Temperature Dependence ◽  
Thymidylate Synthase ◽  
Theoretical Study ◽  
Isotope Effects ◽  
Kinetic Isotope Effects ◽  
Kinetic Isotope
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