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All data (experiment and calculated) in the CCCBDB for HBO (Boron hydride oxide)

1907021335
Other names
Boron hydride oxide; oxoborane;
INChI
InChI=1S/BHO/c1-2/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   663  
Energy 298.15K   618  
Atomization Enthalpy 298.15K x44x
Atomization Enthalpy 0K x44x
Entropy (298.15K) entropy x16x
Entropy at any temperature   16  
Integrated Heat Capacity integrated heat capacity x16x
Heat Capacity (Cp) Heat capacity x16x
Nuclear Repulsion Energy   613  
HOMO-LUMO Energies HOMO energies   525  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x592  
Internal Coordinates bond lengths bond angles x591x
Products of moments of inertia moments of inertia x592x
Rotational Constants rotational constants x601x
Point Group  628 
Vibrations Vibrational Frequencies vibrations fun. 601x
Vibrational Intensities  688 
Zero-point energies x601x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Raman frequencies and intensities   5  
Electronic States Electronic states x 0  
Electrostatics Atom charges   343  
Dipole dipole  436 
Quadrupole quadrupole  354 
Polarizability polarizability  400 
Other results Spin   0  
Number of basis functions   32  
Conformations   1