return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
You are here: Home > All data for one species

All data (experiment and calculated) in the CCCBDB for SiH- (silicon monohydride anion)

1907021335
INChI
InChI=1S/HSi/h1H/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   411  
Energy 298.15K   397  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  6 
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   403  
HOMO-LUMO Energies HOMO energies   406  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x406  
Internal Coordinates bond lengths bond angles  406 
Products of moments of inertia moments of inertia  396 
Rotational Constants rotational constants  404 
Point Group  407 
Vibrations Vibrational Frequencies vibrations har.403x
Vibrational Intensities  569 
Zero-point energies x403x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Raman frequencies and intensities   5  
Electronic States Electronic states x 0  
Electrostatics Atom charges   239  
Dipole dipole  317 
Quadrupole quadrupole  284 
Polarizability polarizability  291 
Other results Spin   405  
Number of basis functions   101  
Conformations   1