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

All data (experiment and calculated) in the CCCBDB for AsH3+ (Arsine cation)

INChI
InChI=1S/AsH3/h1H3/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   174  
Energy 298.15K   6  
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   167  
HOMO-LUMO Energies HOMO energies   159  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  159  
Internal Coordinates bond lengths bond angles  159 
Products of moments of inertia moments of inertia  156 
Rotational Constants rotational constants  159 
Point Group  168 
Vibrations Vibrational Frequencies vibrations  159 
Vibrational Intensities  140 
Zero-point energies  159 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   81  
Dipole dipole  84 
Quadrupole quadrupole  83 
Polarizability polarizability  84 
Other results Spin   163  
Number of basis functions   20  
Diagnostics   0  
Conformations   1