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I.B.3. (II.A.2.)

All data (experiment and calculated) in the CCCBDB for SeO+ (selenium monoxide cation)

INChI
InChI=1S/OSe/c1-2/q+1

An "x" indicates that data is available. A number indicates how many calculations have been completed.
Property Experiment Calculated Comparison
Energies
Entropies		 Enthalpy 298.15K enthalpy of formation      
Enthalpy 0K enthalpy of formation      
Energy 0K   212  
Energy 298.15K   8  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  0 
Entropy (298.15K) entropy  0 
Entropy at any temperature   0  
Integrated Heat Capacity integrated heat capacity  0 
Heat Capacity (Cp) Heat capacity  0 
Nuclear Repulsion Energy   207  
HOMO-LUMO Energies HOMO energies   206  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  206  
Internal Coordinates bond lengths bond angles  206 
Products of moments of inertia moments of inertia  201 
Rotational Constants rotational constants  206 
Point Group  208 
Vibrations Vibrational Frequencies vibrations  206 
Vibrational Intensities  192 
Zero-point energies  206 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   120  
Dipole dipole  124 
Quadrupole quadrupole  124 
Polarizability polarizability  125 
Other results Spin   205  
Number of basis functions   27  
Diagnostics   1  
Conformations   1