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

All data (experiment and calculated) in the CCCBDB for HF+ (hydrogen fluoride cation)

INChI
InChI=1S/FH/h1H/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   253  
Energy 298.15K   236  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  0 
Entropy (298.15K) entropy  218 
Entropy at any temperature   218  
Integrated Heat Capacity integrated heat capacity  218 
Heat Capacity (Cp) Heat capacity  218 
Nuclear Repulsion Energy   246  
HOMO-LUMO Energies HOMO energies   245  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x231  
Internal Coordinates bond lengths bond angles x231x
Products of moments of inertia moments of inertia x238x
Rotational Constants rotational constants x245x
Point Group  247 
Vibrations Vibrational Frequencies vibrations x246x
Vibrational Intensities  225 
Zero-point energies x246x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   137  
Dipole dipole  142 
Quadrupole quadrupole  142 
Polarizability polarizability  141 
Other results Spin   244  
Number of basis functions   36  
Diagnostics   1  
Conformations   1