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 CH₂FCl (fluorochloromethane)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		290
	Energy 298.15K		277
	Atomization Enthalpy 298.15K	x	175	x
	Atomization Enthalpy 0K		180
	Entropy (298.15K)	x	170	x
	Entropy at any temperature		170
	Integrated Heat Capacity		170
	Heat Capacity (Cp)		170
	Nuclear Repulsion Energy		259
	HOMO-LUMO Energies		263
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	264
	Internal Coordinates	x	263	x
	Products of moments of inertia	x	261	x
	Rotational Constants	x	264	x
	Point Group		265
Vibrations	Vibrational Frequencies	fun.	257	x
	Vibrational Intensities		276
	Zero-point energies	x	257	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants		1
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		175
	Dipole	x	200	x
	Quadrupole		185
	Polarizability	x	184	x
Other results	Spin		0
	Number of basis functions		7
	Conformations		1