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

All data (experiment and calculated) in the CCCBDB for SiF2 (Silicon difluoride)

Other names
Difluorosilylene; Silicon difluoride;
INChI
InChI=1S/F2Si/c1-3-2

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   632  
Energy 298.15K   13  
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   629  
HOMO-LUMO Energies HOMO energies   615  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x285  
Internal Coordinates bond lengths bond angles x285x
Products of moments of inertia moments of inertia x600x
Rotational Constants rotational constants x609x
Point Group  631 
Vibrations Vibrational Frequencies vibrations x596x
Vibrational Intensities  549 
Zero-point energies  596 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states x 332  
Electrostatics Atom charges   387  
Dipole dipole  387 
Quadrupole quadrupole  387 
Polarizability polarizability  358 
Other results Spin   330  
Number of basis functions   28  
Diagnostics   0  
Conformations   1