propanamide, ethane carbonamide, propionamide C2H5CONH2

XYZ [1KB]


Orbital data (ISO value 0.1)

Orbital 20 (HOMO)
PGV [375KB]
WRL [468KB]

Orbital 21 (LUMO)
PGV [380KB]
WRL [474KB]


Gaussian outputs

optimize [356KB]

frequency [97KB]

orbitals [24KB]


PGV Samples / Copyright(C) 1996-1997 CCIMS / mizutani@ims.ac.jp