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

All data (experiment and calculated) in the CCCBDB for HNS- (HNS-)

INChI
InChI=1S/HNS/c1-2/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      
Enthalpy 0K enthalpy of formation      
Energy 0K   301  
Energy 298.15K   7  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  0 
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   300  
HOMO-LUMO Energies HOMO energies   297  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  300  
Internal Coordinates bond lengths bond angles  300 
Products of moments of inertia moments of inertia  291 
Rotational Constants rotational constants  296 
Point Group  301 
Vibrations Vibrational Frequencies vibrations  296 
Vibrational Intensities  264 
Zero-point energies  296 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   180  
Dipole dipole  183 
Quadrupole quadrupole  184 
Polarizability polarizability  170 
Other results Spin   292  
Number of basis functions   28  
Diagnostics   0  
Conformations   1