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

All data (experiment and calculated) in the CCCBDB for LiF+ (lithium fluoride cation)

INChI
InChI=1S/FH.Li/h1H;/q;+2/p-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   277  
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   272  
HOMO-LUMO Energies HOMO energies   271  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  255  
Internal Coordinates bond lengths bond angles  255 
Products of moments of inertia moments of inertia  264 
Rotational Constants rotational constants  271 
Point Group  273 
Vibrations Vibrational Frequencies vibrations  272 
Vibrational Intensities  238 
Zero-point energies  272 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   151  
Dipole dipole  155 
Quadrupole quadrupole  155 
Polarizability polarizability  139 
Other results Spin   270  
Number of basis functions   33  
Diagnostics   1  
Conformations   1