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All data (experiment and calculated) in the CCCBDB for HFCO (formyl fluoride)

1907021335
INChI
InChI=1S/CHFO/c2-1-3/h1H

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   288  
Energy 298.15K   272  
Atomization Enthalpy 298.15K x175x
Atomization Enthalpy 0K  174 
Entropy (298.15K) entropy x184x
Entropy at any temperature   184  
Integrated Heat Capacity integrated heat capacity  184 
Heat Capacity (Cp) Heat capacity  184 
Nuclear Repulsion Energy   275  
HOMO-LUMO Energies HOMO energies   279  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x268  
Internal Coordinates bond lengths bond angles x268x
Products of moments of inertia moments of inertia x275x
Rotational Constants rotational constants x279x
Point Group  280 
Vibrations Vibrational Frequencies vibrations fun. 272x
Vibrational Intensities  292 
Zero-point energies x272x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Raman frequencies and intensities   4  
Electronic States Electronic states x 0  
Electrostatics Atom charges   181  
Dipole dipole x206x
Quadrupole quadrupole  192 
Polarizability polarizability  192 
Other results Spin   0  
Number of basis functions   41  
Conformations   1