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

All data (experiment and calculated) in the CCCBDB for NF3+ (Nitrogen trifluoride cation)

INChI
InChI=1S/F3N/c1-4(2)3/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   257  
Energy 298.15K   11  
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   254  
HOMO-LUMO Energies HOMO energies   253  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  253  
Internal Coordinates bond lengths bond angles  253 
Products of moments of inertia moments of inertia  245 
Rotational Constants rotational constants  253 
Point Group  255 
Vibrations Vibrational Frequencies vibrations  267 
Vibrational Intensities  246 
Zero-point energies  267 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   145  
Dipole dipole  157 
Quadrupole quadrupole  155 
Polarizability polarizability  143 
Other results Spin   252  
Number of basis functions   34  
Diagnostics   0  
Conformations   1