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 OClO (Chlorine dioxide)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		874
	Energy 298.15K		71
	Atomization Enthalpy 298.15K	x	25	x
	Atomization Enthalpy 0K	x	28	x
	Entropy (298.15K)	x	19	x
	Entropy at any temperature		19
	Integrated Heat Capacity	x	19	x
	Heat Capacity (Cp)	x	19	x
	Nuclear Repulsion Energy		849
	HOMO-LUMO Energies		718
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	822
	Internal Coordinates	x	822	x
	Products of moments of inertia	x	814	x
	Rotational Constants	x	824	x
	Point Group		851
Vibrations	Vibrational Frequencies	fun.	809	x
	Vibrational Intensities		1099
	Zero-point energies	x	809	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
	Raman frequencies and intensities		525
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		496
	Dipole	x	657	x
	Quadrupole		546
	Polarizability		533
Other results	Spin		848
	Number of basis functions		85
	Conformations		1