Ultrafast evolution of imidazole after electronic excitation

J Phys Chem A. 2012 Nov 8;116(44):10752-8. doi: 10.1021/jp3078198. Epub 2012 Oct 30.

Abstract

The ultrafast dynamics of the imidazole chromophore has been tracked after electronic excitation in the 250-217 nm energy region, by time delayed ionization with 800 nm laser pulses. The time-dependent signals collected at the imidazole(+) mass channel show the signature of femtosecond dynamics, originating on the πσ*- and ππ*-type states located in the explored energy region. The fitting of the transients, which due to the appearance of nonresonant coherent adiabatic excitation requires a quantum treatment based in the Bloch equations, yields two lifetimes of 18 ± 4 and 19 ± 4 fs. The first is associated with the πσ* ← ππ* internal conversion, while the second reflects the loss of ionization cross-section as the system evolves along the dissociative πσ* surface. This study provides a comprehensive picture of the photophysics of the molecule that agrees with previous experimental and theoretical findings.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Electrons*
  • Imidazoles / chemistry*
  • Quantum Theory*

Substances

  • Imidazoles
  • imidazole