Gw. Ding et al., EFFECTS OF REAGENT ORBITAL ALIGNMENT ON PRODUCT VIBRATIONAL DISTRIBUTIONS OF THE CHEMILUMINESCENT REACTION CA(P-1(1))+CH3I, Chemical physics letters, 265(3-5), 1997, pp. 392-398
Experimental results of the reaction Ca(P-1(1)) + CH3I show that the r
eagent orbital alignment of Ca(P-1(1)) can influence the product vibra
tional distributions. In the A(2) Pi state of CaI product, the vibrati
onal distribution is shifted from low to high levels as the alignment
of the p orbital of Ca(P-1(1)) is changing from parallel to perpendicu
lar, relative to the reagent average velocity, but this effect is oppo
site in the B-2 Sigma State of CaI product. Theoretical analyses show
that impact parameters are sensitive to both product vibrational distr
ibutions and reagent orbital alignment effect on product electronic st
ates. These relations are used to interpret the experimental results.