Fourier transform microwave spectroscopy of Criegee intermediates: The conformational behaviour of butyraldehyde oxide

Abstract

Four conformers of the n-propyl-substituted Criegee intermediate, CH

CH

CH

CHOO, also named n-butyraldehyde oxide, have been observed by Fourier transform microwave spectroscopy. The transient species was produced using a pulsed electric discharge of a gas mixture of 1,1-diiodobutane/O

diluted in Ar or Ne. The observation of only syn species is in contrast to the results of other previous studies of alkyl-substituted Criegee intermediates, in particular, those for the structural isomers, isobutyraldehyde oxide ((CH

)

CHCHOO), and methyl-ethyl-ketone oxide (C

H

C(CH

)OO), for which syn and anti species have been observed coexisting in the gas phase.