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 AsCl₃ (Arsenous trichloride)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		442
	Energy 298.15K		418
	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		442
	HOMO-LUMO Energies		400
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	440
	Internal Coordinates	x	440	x
	Products of moments of inertia		433
	Rotational Constants	x	440	x
	Point Group		443
Vibrations	Vibrational Frequencies	har.	435	x
	Vibrational Intensities		403
	Zero-point energies	x	435	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		261
	Dipole	x	364	x
	Quadrupole		294
	Polarizability	x	311	x
Other results	Spin		0
	Number of basis functions		26
	Conformations		1