15min:
MICROWAVE INVESTIGATION OF SULFURIC ACID MONOHYDRATE.

D. L. FIACCO, S. W. HUNT AND K. R. LEOPOLD, Department of Chemistry, University of Minnesota, Minneapolis, MN 55455.

We report the first microwave spectroscopic investigation of the 1:1 complex of H2O-H2SO4 and several of its deuterated and 18O containing isotopomers. The complex is prepared in situ via reaction of water and SO3 using a co-injection source in which H2O vapor is introduced into the early stages of an Ar + SO3 expansion. Both a- and c- type spectra for fourteen isotopomers have been measured and are consistent in all cases with that of a near-prolate rotor with appreciable dipole moment components along the a- and c- inertial axes. The spectra of the isotopomers containing H216O are complicated by internal motion of the water unit affecting both the a-type K-1 = 0 and several of the c-type transitions. The possible internal motions giving rise to the observed spectral splittings as well as the ground state structural parameters of the H2O-H2SO4 complex will be discussed and compared to recent DFT calculations.,