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

All data (experiment and calculated) in the CCCBDB for AsH (Arsenic monohydride)

INChI
InChI=1S/AsH/h1H

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   267  
Energy 298.15K   8  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  0 
Entropy (298.15K) entropy x0x
Entropy at any temperature   0  
Integrated Heat Capacity integrated heat capacity x0x
Heat Capacity (Cp) Heat capacity x0x
Nuclear Repulsion Energy   260  
HOMO-LUMO Energies HOMO energies   259  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  259  
Internal Coordinates bond lengths bond angles  259 
Products of moments of inertia moments of inertia  254 
Rotational Constants rotational constants  259 
Point Group  261 
Vibrations Vibrational Frequencies vibrations x259x
Vibrational Intensities  227 
Zero-point energies x259x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   144  
Dipole dipole  144 
Quadrupole quadrupole  144 
Polarizability polarizability  131 
Other results Spin   260  
Number of basis functions   26  
Diagnostics   0  
Conformations   1