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

All data (experiment and calculated) in the CCCBDB for ZnF- (Zinc monofluoride anion)


An "x" indicates that data is available. A number indicates how many calculations have been completed.
Property Experiment Calculated Comparison
Enthalpy 298.15K enthalpy of formation      
Enthalpy 0K enthalpy of formation      
Energy 0K   14  
Energy 298.15K   1  
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   15  
HOMO-LUMO Energies HOMO energies   15  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  15  
Internal Coordinates bond lengths bond angles  14 
Products of moments of inertia moments of inertia  14 
Rotational Constants rotational constants  15 
Point Group  16 
Vibrations Vibrational Frequencies vibrations  14 
Vibrational Intensities  14 
Zero-point energies  14 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   1  
Dipole dipole  11 
Quadrupole quadrupole  7 
Polarizability polarizability  11 
Other results Spin   4  
Number of basis functions   3  
Diagnostics   0  
Conformations   1