State-to-state dynamics of the H+c-C6H12 -> H-2(v ',j ')+c-C6H11 reaction

Citation
A. Srivastava et al., State-to-state dynamics of the H+c-C6H12 -> H-2(v ',j ')+c-C6H11 reaction, J CHEM PHYS, 115(6), 2001, pp. 2560-2565
Citations number
38
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF CHEMICAL PHYSICS
ISSN journal
00219606 → ACNP
Volume
115
Issue
6
Year of publication
2001
Pages
2560 - 2565
Database
ISI
SICI code
0021-9606(20010808)115:6<2560:SDOTH->2.0.ZU;2-2
Abstract
The rovibrational state distributions for the H-2 product of the H+c-C6H12- ->H-2+c-C6H11 abstraction reaction have been measured at 1.6 eV collision e nergy under single-collision conditions. The state distributions are compar ed to those for the H-2 product of the reaction of H atoms with CD3(CH2)(4) CD3 and n-C6H14 that we have measured previously. Abstraction of secondary H atoms from the cyclic C-6 alkane produces H-2(v(')=0,j(')) and H-2(v(')=1 ,j(')) rotational state distributions that are significantly colder than th ose from the reaction of the linear C-6 alkane. These results are interpret ed within a simple phenomenological local reaction model that we have devel oped for these atom+polyatom reactions. The substantial differences between the state distributions for the reactions of the cyclic and linear alkanes indicate that reactions of cyclohexane are not representative of reactions at all secondary C-H. (C) 2001 American Institute of Physics.