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 ClFO₃ (Perchloryl fluoride)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		238
	Energy 298.15K		226
	Atomization Enthalpy 298.15K	x	158	x
	Atomization Enthalpy 0K	x	166	x
	Entropy (298.15K)	x	161	x
	Entropy at any temperature		161
	Integrated Heat Capacity	x	161	x
	Heat Capacity (Cp)	x	161	x
	Nuclear Repulsion Energy		214
	HOMO-LUMO Energies		211
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	200
	Internal Coordinates	x	199	x
	Products of moments of inertia	x	211	x
	Rotational Constants	x	215	x
	Point Group		216
Vibrations	Vibrational Frequencies	fun.	211	x
	Vibrational Intensities		225
	Zero-point energies	x	211	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		177
	Dipole	x	185	x
	Quadrupole		176
	Polarizability		164
Other results	Spin		0
	Number of basis functions		6
	Conformations		1