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 BrCl⁺ (bromine chloride cation)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		81
	Energy 298.15K		55
	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		71
	HOMO-LUMO Energies		61
	Barriers to Internal Rotation		0
Geometries	Cartesians		86
	Internal Coordinates		86
	Products of moments of inertia		55
	Rotational Constants		59
	Point Group		75
Vibrations	Vibrational Frequencies		59
	Vibrational Intensities		233
	Zero-point energies		59
	Vibrational scaling factors
	Anharmonic frequencies and constants
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		38
	Dipole		50
	Quadrupole		45
	Polarizability		180
Other results	Spin		74
	Number of basis functions		83
	Conformations		1