o-cresol,o-methylphenol C7H8O
XYZ [1KB]
Orbital data (ISO value 0.05)
Orbital 29 (HOMO)
PGV [1136KB]
WRL [1433KB]
Orbital 30 (LUMO)
PGV [1123KB]
WRL [1416KB]
Gaussian outputs
- optimize [584KB]
- frequency [99KB]
- orbitals [30KB]
PGV Samples /
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mizutani@ims.ac.jp