At present is is possible to view the vibrational modes of a molecule as a table. It would be nice to be able to view these as a IR spectrum. This can currently be achieved if the plot does not contain any information about the mode intensities and simply shows all the vibrational modes as equally weighted peaks. Further development from ChemShell would be needed to gain access to mode intensity data to create a full IR spectrum.
At present is is possible to view the vibrational modes of a molecule as a table. It would be nice to be able to view these as a IR spectrum. This can currently be achieved if the plot does not contain any information about the mode intensities and simply shows all the vibrational modes as equally weighted peaks. Further development from ChemShell would be needed to gain access to mode intensity data to create a full IR spectrum.