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

All data (experiment and calculated) in the CCCBDB for AsO (Arsenic monoxide)

INChI
InChI=1S/AsO/c1-2

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   255  
Energy 298.15K   8  
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   250  
HOMO-LUMO Energies HOMO energies   245  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  245  
Internal Coordinates bond lengths bond angles  245 
Products of moments of inertia moments of inertia  239 
Rotational Constants rotational constants  244 
Point Group  251 
Vibrations Vibrational Frequencies vibrations x244x
Vibrational Intensities  215 
Zero-point energies x244x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   137  
Dipole dipole  137 
Quadrupole quadrupole  133 
Polarizability polarizability  123 
Other results Spin   248  
Number of basis functions   4  
Diagnostics   0  
Conformations   1