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 HCS (Thioformyl radical)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		106
	Energy 298.15K		67
	Atomization Enthalpy 298.15K	x	10	x
	Atomization Enthalpy 0K		12
	Entropy (298.15K)		7
	Entropy at any temperature		7
	Integrated Heat Capacity		7
	Heat Capacity (Cp)		7
	Nuclear Repulsion Energy		90
	HOMO-LUMO Energies		94
	Barriers to Internal Rotation		0
Geometries	Cartesians		99
	Internal Coordinates		94
	Products of moments of inertia		91
	Rotational Constants		94
	Point Group		98
Vibrations	Vibrational Frequencies		92
	Vibrational Intensities		288
	Zero-point energies		92
	Vibrational scaling factors
	Anharmonic frequencies and constants
	Raman frequencies and intensities		10
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		67
	Dipole		84
	Quadrupole		78
	Polarizability		228
Other results	Spin		91
	Number of basis functions		50
	Conformations		2	x