Theoretical kinetic study of the reactions of cycloalkylperoxy radicals

Journal of Physical Chemistry A

Volumn 113, Issue 25, 2009, Pages 6924-6935

  Sirjean, B ^a   Glaude, P A ^a   Ruiz Lopez M F ^b   Fournet R ^a  

^a CNRS   (France)

^b NANCY UNIVERSITÉ   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ALKYL RADICALS; ARRHENIUS EXPRESSIONS; CBS-QB3; CYCLIC ETHER; CYCLO-ALKANES; DECOMPOSITION PATHWAY; ELEMENTARY REACTION; EXPERIMENTAL DATA; GAS-PHASE REACTIONS; H-ATOM TRANSFER; HINDERED ROTORS; INTERMEDIATE TEMPERATURES; ISODESMIC REACTIONS; KEY REACTIONS; KINETIC STUDY; LOW-TEMPERATURE OXIDATION; QUANTUM CHEMICAL CALCULATIONS; REACTION MECHANISM; TEMPERATURE RANGE; THEORETICAL STUDY; THERMOCHEMICAL DATA; TRANSITION STATE THEORIES; TUNNELING EFFECTS;

ETHERS; FREE RADICAL REACTIONS; ORGANIC COMPOUNDS; OXYGEN; PHASE INTERFACES; QUANTUM CHEMISTRY;

RATE CONSTANTS;

CYCLOALKANE DERIVATIVE; FREE RADICAL; OXYGEN;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; KINETICS; OXIDATION REDUCTION REACTION; QUANTUM THEORY; TEMPERATURE; THERMODYNAMICS;

COMPUTER SIMULATION; CYCLOPARAFFINS; FREE RADICALS; KINETICS; MODELS, CHEMICAL; OXIDATION-REDUCTION; OXYGEN; QUANTUM THEORY; TEMPERATURE; THERMODYNAMICS;

EID: 67549124814     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp901492e     Document Type: Article

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