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All data (experiment and calculated) in the CCCBDB for BeN- (Beryllium mononitride anion)

1907021335
INChI
InChI=1S/Be.N/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   325  
Energy 298.15K   312  
Atomization Enthalpy 298.15K  6 
Atomization Enthalpy 0K  201 
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   317  
HOMO-LUMO Energies HOMO energies   320  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  304  
Internal Coordinates bond lengths bond angles  303 
Products of moments of inertia moments of inertia  310 
Rotational Constants rotational constants  318 
Point Group  321 
Vibrations Vibrational Frequencies vibrations  319 
Vibrational Intensities  244 
Zero-point energies  319 
Vibrational scaling factors  
Anharmonic frequencies and constants      
Raman frequencies and intensities   5  
Electronic States Electronic states x 0  
Electrostatics Atom charges   178  
Dipole dipole  199 
Quadrupole quadrupole  194 
Polarizability polarizability  156 
Other results Spin   5  
Number of basis functions   128  
Conformations   1