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All data (experiment and calculated) in the CCCBDB for BF2 (Boron difluoride radical)

1907021335
INChI
InChI=1S/BF2/c2-1-3

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 x    
Enthalpy 0K enthalpy of formation      
Energy 0K   571  
Energy 298.15K   553  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  0 
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   548  
HOMO-LUMO Energies HOMO energies   495  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  572  
Internal Coordinates bond lengths bond angles  572 
Products of moments of inertia moments of inertia  564 
Rotational Constants rotational constants  572 
Point Group  573 
Vibrations Vibrational Frequencies vibrations fun. 572x
Vibrational Intensities  500 
Zero-point energies x572x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Raman frequencies and intensities   5  
Electronic States Electronic states x 0  
Electrostatics Atom charges   344  
Dipole dipole  450 
Quadrupole quadrupole  373 
Polarizability polarizability  372 
Other results Spin   572  
Number of basis functions   32  
Conformations   1