ChemInform Abstract: KINETIC ENERGY RELEASE AND POSITION OF TRANSITION STATE DURING INTRAMOLECULAR AROMATIC SUBSTITUTION IN IONIZED 1-PHENYL-1-(2-PYRIDYL)ETHYLENES

1980 ◽  
Vol 11 (44) ◽  
Author(s):  
R. SCHUBERT ◽  
H.-F. GRUETZMACHER
Keyword(s):  
Kinetic Energy ◽  
Transition State ◽  
Energy Release ◽  
Kinetic Energy Release ◽  
Aromatic Substitution

Kinetic Energy Release and Position of the Transition State for С6Н7+ Ions Produced from Isomeric C7H8O Precursors

1991 ◽  
Vol 46 (12) ◽  
pp. 1021-1025 ◽  
Author(s):  
Ezzat T. M. Selim ◽  
M. A. Rabbih ◽  
M. A. Fahmey
Keyword(s):  
Kinetic Energy ◽  
Transition State ◽  
Energy Release ◽  
Benzyl Alcohol ◽  
Kinetic Energy Release ◽  
Heat Of Formation ◽  
Molecular Ions ◽  
Energy Partitioning ◽  
Endothermic Reaction ◽  
Late Transition

Abstract The energetic requirement and mechanisms for CHO' loss from the molecular ions of isomeric C7H8O precursors have been reported. The heat of formation of [C6H7]+ (protonated benzene) was determined and ε* evaluated. Measurement of the kinetic energy release TB gives the energy-partitioning quotients q= TB/εr* which range from 0.38 to 0.99. The energy available and TB are small for the strongly endothermic reaction of benzyl alcohol but increase sharply in the case of the weakly endothermic reaction of anisole. All reactions have "late" transition states, the position X0*of the transition state on the reaction coordinate varying from 0.64 to 0.93

Kinetic energy release as a transition state probe

1977 ◽  
Vol 99 (9) ◽  
pp. 3192-3194 ◽  
Author(s):  
Dudley H. Williams ◽  
Richard D. Bowen
Keyword(s):  
Kinetic Energy ◽  
Transition State ◽  
Energy Release ◽  
Kinetic Energy Release

Isotope effects on kinetic energy release. Elimination of CH4 from [CH3CHOH]+ and [CH2OCH3]+

1989 ◽  
Vol 93 (2) ◽  
pp. 215-223 ◽  
Author(s):  
Kevin F. Donchi ◽  
Einar Uggerud ◽  
Georg Hvistendahl ◽  
Peter J. Derrick
Keyword(s):  
Kinetic Energy ◽  
Energy Release ◽  
Isotope Effects ◽  
Kinetic Energy Release
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