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

All data (experiment and calculated) in the CCCBDB for BrO (Bromine monoxide)

INChI
InChI=1S/BrO/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   251  
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   251  
HOMO-LUMO Energies HOMO energies   257  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x232  
Internal Coordinates bond lengths bond angles x232x
Products of moments of inertia moments of inertia x223x
Rotational Constants rotational constants x228x
Point Group  258 
Vibrations Vibrational Frequencies vibrations x228x
Vibrational Intensities  210 
Zero-point energies x228x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   123  
Dipole dipole  123 
Quadrupole quadrupole  123 
Polarizability polarizability  127 
Other results Spin   250  
Number of basis functions   26  
Diagnostics   0  
Conformations   1