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 C₆H₄F₂ (metadifluorobenzene)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		8
	Energy 298.15K		3
	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		9
	HOMO-LUMO Energies		9
	Barriers to Internal Rotation		0
Geometries	Cartesians		9
	Internal Coordinates		8
	Products of moments of inertia		8
	Rotational Constants		9
	Point Group		10
Vibrations	Vibrational Frequencies		8
	Vibrational Intensities		8
	Zero-point energies		8
	Vibrational scaling factors
	Anharmonic frequencies and constants
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		8
	Dipole	x	8	x
	Quadrupole		7
	Polarizability		8
Other results	Spin		0
	Number of basis functions		0
	Conformations		1