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

All data (experiment and calculated) in the CCCBDB for AlS+ (aluminum monosulfide cation)

INChI
InChI=1S/Al.S/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   224  
Energy 298.15K   10  
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   219  
HOMO-LUMO Energies HOMO energies   218  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  218  
Internal Coordinates bond lengths bond angles  218 
Products of moments of inertia moments of inertia  211 
Rotational Constants rotational constants  218 
Point Group  220 
Vibrations Vibrational Frequencies vibrations  218 
Vibrational Intensities  204 
Zero-point energies  218 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   124  
Dipole dipole  128 
Quadrupole quadrupole  128 
Polarizability polarizability  129 
Other results Spin   0  
Number of basis functions   32  
Diagnostics   1  
Conformations   1