Problems and Prospects |
!!!But!!!
All files are small and easy to load!
Spartan, Gaussian, and Hyperchem are all readily available for vibrational computations!!
The hand-eye coordination possibilities for IR spectral investigation are very useful!!!
The extension to mass spectroscopy (show dynamic
molecule fragmentation), and
NMR spectroscopy (peak pick to highly molecular fragment), and other spectra/graphs versus
structure
correlations is extremely promising!!!!