ethylmethyl ether C3H8O

XYZ [1KB]


Orbital data (ISO value 0.1)

Orbital 17 (HOMO)
PGV [338KB]
WRL [422KB]

Orbital 18 (LUMO)
PGV [142KB]
WRL [180KB]


Gaussian outputs

optimize [169KB]

frequency [95KB]

orbitals [23KB]


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