return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All data (experiment and calculated) in the CCCBDB for SiH2- (silicon dihydride anion)

1907021335
INChI
InChI=1S/H2Si/h1H2/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      
Enthalpy 0K enthalpy of formation      
Energy 0K   300  
Energy 298.15K   289  
Atomization Enthalpy 298.15K  2 
Atomization Enthalpy 0K  233 
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   289  
HOMO-LUMO Energies HOMO energies   292  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  291  
Internal Coordinates bond lengths bond angles  290 
Products of moments of inertia moments of inertia  287 
Rotational Constants rotational constants  292 
Point Group  293 
Vibrations Vibrational Frequencies vibrations  290 
Vibrational Intensities  273 
Zero-point energies  290 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Raman frequencies and intensities   5  
Electronic States Electronic states x 0  
Electrostatics Atom charges   167  
Dipole dipole  189 
Quadrupole quadrupole  184 
Polarizability polarizability  177 
Other results Spin   279  
Number of basis functions   79  
Conformations   1