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All data (experiment and calculated) in the CCCBDB for C5H10 (2-Pentene, (Z)-)

1907021335
Other names
2-(Z)-C5H10; (Z)-2-Pentene; 2-Pentene, (Z)-; cis-β-Amylene; cis-2-Pentene; cis-Pentene; (Z)-pent-2-ene;
INChI
InChI=1S/C5H10/c1-3-5-4-2/h3,5H,4H2,1-2H3/b5-3-

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   227  
Energy 298.15K   219  
Atomization Enthalpy 298.15K x159x
Atomization Enthalpy 0K x163x
Entropy (298.15K) entropy x153x
Entropy at any temperature   153  
Integrated Heat Capacity integrated heat capacity x153x
Heat Capacity (Cp) Heat capacity x153x
Nuclear Repulsion Energy   214  
HOMO-LUMO Energies HOMO energies   212  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  191  
Internal Coordinates bond lengths bond angles x190x
Products of moments of inertia moments of inertia x207x
Rotational Constants rotational constants x212x
Point Group  213 
Vibrations Vibrational Frequencies vibrations  209 
Vibrational Intensities  219 
Zero-point energies  209 
Vibrational scaling factors  
Anharmonic frequencies and constants   1  
Raman frequencies and intensities   0  
Electronic States Electronic states x 0  
Electrostatics Atom charges   178  
Dipole dipole x187x
Quadrupole quadrupole  180 
Polarizability polarizability  166 
Other results Spin   0  
Number of basis functions   6  
Conformations   1