butylamine C4H9NH2

Orbital data (ISO value 0.1)

Orbital 21 (HOMO)

PGV [316KB]
WRL [397KB]

Orbital 22 (LUMO)
PGV [114KB]
WRL [147KB]

Gaussian outputs

optimize [235KB]

frequency [103KB]

orbitals [33KB]

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