M. Chachisvilis et al., FEMTOSECOND DYNAMICS OF A HYDROGEN-BONDED MODEL BASE-PAIR IN THE CONDENSED-PHASE - DOUBLE PROTON-TRANSFER IN 7-AZAINDOLE, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(4), 1998, pp. 669-673
Femtosecond, real-time dynamics of a hydrogen-bonded model base pair (
7-azaindole dimer) in the condensed phase is presented and compared wi
th gas-phase, molecular beam studies. Following the preparation of a w
ave packet (nonequilibrium state), we resolved the initial decay of th
e reactive pair and the rise of the tautomer in two solvents. Studies
of the isotope effect, solvent viscosity, energy dependence, and polar
ization anisotropy are consistent with direct and indirect reaction pa
thways for the double proton transfer on a global potential energy sur
face.