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

All data (experiment and calculated) in the CCCBDB for CCl2- (dichloromethylene anion)

INChI
InChI=1S/CCl2/c2-1-3/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 x    
Enthalpy 0K enthalpy of formation      
Energy 0K   262  
Energy 298.15K   8  
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   255  
HOMO-LUMO Energies HOMO energies   255  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  252  
Internal Coordinates bond lengths bond angles  252 
Products of moments of inertia moments of inertia  245 
Rotational Constants rotational constants  250 
Point Group  256 
Vibrations Vibrational Frequencies vibrations  250 
Vibrational Intensities  220 
Zero-point energies  250 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   139  
Dipole dipole  142 
Quadrupole quadrupole  141 
Polarizability polarizability  128 
Other results Spin   251  
Number of basis functions   32  
Diagnostics   0  
Conformations   1