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 CHCl₂ (dichloromethyl radical)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		946
	Energy 298.15K		461
	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		948
	HOMO-LUMO Energies		838
	Barriers to Internal Rotation		0
Geometries	Cartesians		948
	Internal Coordinates		948
	Products of moments of inertia		932
	Rotational Constants		948
	Point Group		950
Vibrations	Vibrational Frequencies	fun.	948	x
	Vibrational Intensities		846
	Zero-point energies		948
	Vibrational scaling factors
	Anharmonic frequencies and constants
	Raman frequencies and intensities		10
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		581
	Dipole		738
	Quadrupole		624
	Polarizability		617
Other results	Spin		948
	Number of basis functions		93
	Conformations		2	x