The embedded FTIR of acetophenone was recorded in the vapour phase at NIST.
The xyz files were calculated from output by SPARTAN by E. Motyka & Prof P. Lahti. A ZIP file
containing all calculated XYZ files is available.
This demonstration was assembled at NERMMW
7th June 1998 and last modified 17th November 1998.
Created and maintained by Robert John Lancashire,
The Department of Chemistry, University of the West Indies,
Mona Campus, Kingston 7, Jamaica.