J. Prochorow et al., Laser-induced emission spectroscopy of acridine cooled in a supersonic jet: the role of dimers and hydrogen-bonding in photophysics of acridine, J MOL STRUC, 555, 2000, pp. 97-106
The formation of acridine (ACD) dimers under supersonic jet-cooling conditi
ons has been established by the observations of laser-induced fluorescence
and fluorescence excitation spectra. The structure of ACD dimers predicted
by using the semiempirical AM1 parametric method suggests the possibility o
f the formation of hydrogen bonds between ACD moieties in the dimers. This
possibility is verified with use the of the PM3 parametric method. The conf
iguration interaction calculations performed for optimized dimer structures
gives clear insights into the physical mechanism of the enhancement of the
radiative processes in dimers (which, however, seems to be limited to spec
ific conditions of supersonic expansions). The well-known role of hydrogen-
bonding in the photophysics of ACD in protic liquid solutions is also Suppo
rted by the results of preliminary observations under supersonic jet-coolin
g. (C) 2000 Elsevier Science B.V. All rights reserved.