Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All data (experiment and calculated) in the CCCBDB for CHClCHCH₂CH₃ ((Z)-1-Chloro-1-butene)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		217
	Energy 298.15K		212
	Atomization Enthalpy 298.15K	x	156	x
	Atomization Enthalpy 0K		158
	Entropy (298.15K)		160
	Entropy at any temperature		160
	Integrated Heat Capacity		160
	Heat Capacity (Cp)		160
	Nuclear Repulsion Energy		201
	HOMO-LUMO Energies		201
	Barriers to Internal Rotation		0
Geometries	Cartesians		186
	Internal Coordinates		185
	Products of moments of inertia		197
	Rotational Constants		202
	Point Group		202
Vibrations	Vibrational Frequencies		199
	Vibrational Intensities		209
	Zero-point energies		199
	Vibrational scaling factors
	Anharmonic frequencies and constants		1
	Raman frequencies and intensities		0
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		167
	Dipole		173
	Quadrupole		167
	Polarizability		157
Other results	Spin		0
	Number of basis functions		6
	Conformations		1