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 C₂ClF₃ (Ethene, chlorotrifluoro-)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		508
	Energy 298.15K		10
	Atomization Enthalpy 298.15K		0
	Atomization Enthalpy 0K		0
	Entropy (298.15K)		0
	Entropy at any temperature		0
	Integrated Heat Capacity		0
	Heat Capacity (Cp)		0
	Nuclear Repulsion Energy		509
	HOMO-LUMO Energies		455
	Barriers to Internal Rotation		0
Geometries	Cartesians		509
	Internal Coordinates		509
	Products of moments of inertia	x	501	x
	Rotational Constants	x	509	x
	Point Group		510
Vibrations	Vibrational Frequencies	fun.	491	x
	Vibrational Intensities		450
	Zero-point energies	x	491	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
	Raman frequencies and intensities		366
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		300
	Dipole	x	423	x
	Quadrupole		344
	Polarizability		357
Other results	Spin		0
	Number of basis functions		31
	Conformations		1