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

All data (experiment and calculated) in the CCCBDB for CBr4 (Carbon tetrabromide)

Other names
Tetrabromomethane; Methane, tetrabromo-; Methane tetrabromide; Carbon bromide; perbromomethane;
INChI
InChI=1/CBr4/c2-1(3,4)5

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 x    
Energy 0K   204  
Energy 298.15K   182  
Atomization Enthalpy 298.15K x171x
Atomization Enthalpy 0K x171x
Entropy (298.15K) entropy x176x
Entropy at any temperature   176  
Integrated Heat Capacity integrated heat capacity x176x
Heat Capacity (Cp) Heat capacity x176x
Nuclear Repulsion Energy   196  
HOMO-LUMO Energies HOMO energies   196  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x197  
Internal Coordinates bond lengths bond angles x197x
Products of moments of inertia moments of inertia x194x
Rotational Constants rotational constants x197x
Point Group  198 
Vibrations Vibrational Frequencies vibrations x197x
Vibrational Intensities  193 
Zero-point energies x197x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   129  
Dipole dipole x128x
Quadrupole quadrupole  123 
Polarizability polarizability  130 
Other results Spin   0  
Number of basis functions   4  
Diagnostics   4  
Conformations   1