WebMO Job Summary

16: H(-1), Molecular Orbitals - Gaussian

Calculated Quantities

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Overview

Quantity Value
Route #N B3LYP/6-31G(d) SP GFINPUT POP=FULL Geom=Connectivity
Stoichiometry H(1-)
Symmetry OH
Basis 6-31G(d)
RB3LYP Energy -0.461816668117 Hartree
Dipole Moment 0.0000 Debye
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CPU time 0.5 sec

Molecular Orbitals

Orbital Symmetry Occupancy Spin Energy Actions
1 A1G 2 α 0.18762 Ha
2 A1G 0 α 1.23342 Ha
Electron density
Electrostatic potential
Electrophilic (HOMO) frontier density
Nucleophilic (LUMO) frontier density
Radical frontier density

Quote

CONFIDENCE: THAT QUIET ASSURED FEELING YOU HAVE JUST BEFORE YOU FALL FLAT ON YOUR FACE.