Abstract
The structure of deuterated liquid iso-propanol has been studied with neutron diffraction at the LAD diffractometer at the ISIS spallation source. Measurements were performed at temperatures 190, 220, 250 and 275 K. To correct for inelastic effects a model for the dynamic structure factor which obeys detailed balance and included recoil effects was used. The static molecular structure factor SM(Q) exhibits a pre-peak at about 0.75 Å−1. The origin of the pre-peak, which increases in amplitude with temperature, is presently unknown. The structure of the iso-propanol molecule was obtained from the total pair distribution function and from a fit of the intramolecular form factor f1(Q) to the measured SM(Q) at large Q. The obtained values of the bond length and Debye-Waller factors are in good agreement to those obtained from lower alcohols.
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