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

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

INChI
InChI=1S/FH.Zn/h1H;/q;+1/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   200  
Energy 298.15K   7  
Atomization Enthalpy 298.15K  6 
Atomization Enthalpy 0K  156 
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   198  
HOMO-LUMO Energies HOMO energies   198  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  198  
Internal Coordinates bond lengths bond angles  198 
Products of moments of inertia moments of inertia  192 
Rotational Constants rotational constants  197 
Point Group  199 
Vibrations Vibrational Frequencies vibrations  197 
Vibrational Intensities  178 
Zero-point energies  197 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   117  
Dipole dipole  116 
Quadrupole quadrupole  114 
Polarizability polarizability  104 
Other results Spin   192  
Number of basis functions   3  
Diagnostics   0  
Conformations   1