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 CF₂ClCF₂Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		270
	Energy 298.15K		255
	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		279
	HOMO-LUMO Energies		269
	Barriers to Internal Rotation		273
Geometries	Cartesians		269
	Internal Coordinates		268
	Products of moments of inertia		260
	Rotational Constants		267
	Point Group		284
Vibrations	Vibrational Frequencies		264
	Vibrational Intensities		258
	Zero-point energies		264
	Vibrational scaling factors
	Anharmonic frequencies and constants
	Raman frequencies and intensities		8
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		178
	Dipole	x	204	x
	Quadrupole		177
	Polarizability		200
Other results	Spin		0
	Number of basis functions		25
	Conformations		2	x