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

All data (experiment and calculated) in the CCCBDB for BS- (boron monosulfide anion)

INChI
InChI=1S/BS/c1-2/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   241  
Energy 298.15K   10  
Atomization Enthalpy 298.15K  6 
Atomization Enthalpy 0K  201 
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   235  
HOMO-LUMO Energies HOMO energies   235  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  235  
Internal Coordinates bond lengths bond angles  235 
Products of moments of inertia moments of inertia  227 
Rotational Constants rotational constants  234 
Point Group  236 
Vibrations Vibrational Frequencies vibrations  234 
Vibrational Intensities  220 
Zero-point energies  234 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   129  
Dipole dipole  141 
Quadrupole quadrupole  139 
Polarizability polarizability  143 
Other results Spin   10  
Number of basis functions   5  
Diagnostics   1  
Conformations   1