Kinetics of the Hydrogen Atom Abstraction Reactions from 1-Butanol by Hydroxyl Radical: Theory Matches Experiment and More

2013 ◽  
Vol 117 (2) ◽  
pp. 275-282 ◽  
Author(s):  
Prasenjit Seal ◽  
Gbenga Oyedepo ◽  
Donald G. Truhlar
Keyword(s):  
Hydrogen Atom ◽  
Hydroxyl Radical ◽  
Hydrogen Atom Abstraction ◽  
Radical Theory ◽  
Kinetics Of

Reaction kinetics of hydrogen atom abstraction from isopentanol by the H atom and HO2˙ radical

2018 ◽  
Vol 20 (16) ◽  
pp. 10895-10905
Author(s):  
Prajakta Rajaram Parab ◽  
K. Alexander Heufer ◽  
Ravi Xavier Fernandes
Keyword(s):  
Hydrogen Atom ◽  
Transition State ◽  
Reaction Kinetics ◽  
Hydrogen Atom Abstraction ◽  
Abstraction Reaction ◽  
Kinetics Of ◽  
Ho2 Radical

The formation of the transition state for the H-abstraction reaction from isopentanol by the HO2˙ radical.

scholarly journals Kinetics of Hydrogen Atom Abstraction from Substrate by an Active Site Thiyl Radical in Ribonucleotide Reductase

2014 ◽  
Vol 136 (46) ◽  
pp. 16210-16216 ◽  
Author(s):  
Lisa Olshansky ◽  
Arturo A. Pizano ◽  
Yifeng Wei ◽  
JoAnne Stubbe ◽  
Daniel G. Nocera
Keyword(s):  
Hydrogen Atom ◽  
Ribonucleotide Reductase ◽  
Active Site ◽  
Hydrogen Atom Abstraction ◽  
Thiyl Radical ◽  
Kinetics Of

Hydrogen-atom abstraction from methanol by hydroxyl radical

1989 ◽  
Vol 93 (5) ◽  
pp. 1944-1947 ◽  
Author(s):  
Wayne P. Hess ◽  
Frank P. Tully
Keyword(s):  
Hydrogen Atom ◽  
Hydroxyl Radical ◽  
Hydrogen Atom Abstraction

Vacuum ultra-violet flash photolysis of water vapour

1962 ◽  
Vol 266 (1325) ◽  
pp. 185-197 ◽  
Keyword(s):  
Carbon Dioxide ◽  
Hydrogen Atom ◽  
Complex Formation ◽  
Hydroxyl Radical ◽  
Water Vapour ◽  
Iodine Atom ◽  
Flash Photolysis ◽  
Ultra Violet ◽  
Kinetics Of ◽  
Vacuum Ultra Violet

An apparatus for effecting flash photolysis in the vacuum ultra-violet region is described. Appreciable decompositions of water, carbon dioxide, acetylene, ethylene and methane were effected with a 2000 J flash of 30 p .s duration. A detailed study of water vapour photolysis has established that, in the primary step, at least 90 % of the dissociation leads to a hydrogen atom and a hydroxyl radical. The kinetics of the hydroxyl radical disappearance, following flash photolysis of water vapour in the presence of various third bodies, has been studied. The rate constant is faster in xenon than in helium and other similarities with the data on iodine atom recombination suggest the operation of a mechanism involving intermediate complex formation.

scholarly journals Hydrogen-Atom Abstraction Reaction of CF3CH2OCF3by Hydroxyl Radical

2010 ◽  
Vol 31 (12) ◽  
pp. 3718-3722 ◽  
Author(s):  
Hari Ji Singh ◽  
Bhupesh Kumar Mishra ◽  
Pradeep Kumar Rao
Keyword(s):  
Hydrogen Atom ◽  
Hydroxyl Radical ◽  
Hydrogen Atom Abstraction ◽  
Abstraction Reaction

Ab initio-based kinetics of hydrogen atom abstraction from methyl propionate by H and CH3 radicals: a biodiesel model

2021 ◽  
Author(s):  
Jamelah S. Al-Otaibi ◽  
Mohamed A. M. Mahmoud ◽  
Aljawhara H. Almuqrin ◽  
Tarek M. El-Gogary ◽  
Mohamed A. Abdel-Rahman ◽  
...  
Keyword(s):  
Hydrogen Atom ◽  
Ab Initio ◽  
Hydrogen Atom Abstraction ◽  
Methyl Propionate ◽  
Kinetics Of

Chemical Kinetics of Hydrogen Atom Abstraction from Allylic Sites by 3O2; Implications for Combustion Modeling and Simulation

2017 ◽  
Vol 121 (9) ◽  
pp. 1890-1899 ◽  
Author(s):  
Chong-Wen Zhou ◽  
John M. Simmie ◽  
Kieran P. Somers ◽  
C. Franklin Goldsmith ◽  
Henry J. Curran
Keyword(s):  
Hydrogen Atom ◽  
Modeling And Simulation ◽  
Chemical Kinetics ◽  
Hydrogen Atom Abstraction ◽  
Combustion Modeling ◽  
Kinetics Of
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