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

All data (experiment and calculated) in the CCCBDB for PF- (phosphorus monofluoride anion)

INChI
InChI=1S/FP/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   235  
Energy 298.15K   10  
Atomization Enthalpy 298.15K  5 
Atomization Enthalpy 0K  163 
Entropy (298.15K) entropy x0x
Entropy at any temperature   0  
Integrated Heat Capacity integrated heat capacity  0 
Heat Capacity (Cp) Heat capacity  0 
Nuclear Repulsion Energy   231  
HOMO-LUMO Energies HOMO energies   230  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  230  
Internal Coordinates bond lengths bond angles  230 
Products of moments of inertia moments of inertia  223 
Rotational Constants rotational constants  230 
Point Group  232 
Vibrations Vibrational Frequencies vibrations  230 
Vibrational Intensities  216 
Zero-point energies  230 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   132  
Dipole dipole  136 
Quadrupole quadrupole  136 
Polarizability polarizability  136 
Other results Spin   228  
Number of basis functions   33  
Diagnostics   1  
Conformations   1