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

All data (experiment and calculated) in the CCCBDB for SiH3Cl (chlorosilane)

Other names
Chlorosilane; Silane, chloro-;
INChI
InChI=1/ClH3Si/c1-2/h2H3

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   273  
Energy 298.15K   239  
Atomization Enthalpy 298.15K x233x
Atomization Enthalpy 0K x237x
Entropy (298.15K) entropy x222x
Entropy at any temperature   222  
Integrated Heat Capacity integrated heat capacity x222x
Heat Capacity (Cp) Heat capacity x222x
Nuclear Repulsion Energy   236  
HOMO-LUMO Energies HOMO energies   226  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x207  
Internal Coordinates bond lengths bond angles x207x
Products of moments of inertia moments of inertia x214x
Rotational Constants rotational constants x219x
Point Group  220 
Vibrations Vibrational Frequencies vibrations x215x
Vibrational Intensities  205 
Zero-point energies x215x
Vibrational scaling factors x
Anharmonic frequencies and constants   2  
Electronic States Electronic states x 0  
Electrostatics Atom charges   169  
Dipole dipole x167x
Quadrupole quadrupole  159 
Polarizability polarizability  146 
Other results Spin   0  
Number of basis functions   5  
Diagnostics   6  
Conformations   1