p-cresol,p-methylphenol C7H8O

XYZ [1KB]


Orbital data (ISO value 0.05)

Orbital 29 (HOMO)
PGV [1152KB]
WRL [1454KB]

Orbital 30 (LUMO)
PGV [1072KB]
WRL [1352KB]


Gaussian outputs

optimize [818KB]

frequency [98KB]

orbitals [29KB]


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