I.B.3. (II.A.2.)

All data (experiment and calculated) in the CCCBDB for AsH₃ (Arsine)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		174
	Energy 298.15K		6
	Atomization Enthalpy 298.15K		0
	Atomization Enthalpy 0K		0
	Entropy (298.15K)	x	0	x
	Entropy at any temperature		0
	Integrated Heat Capacity	x	0	x
	Heat Capacity (Cp)	x	0	x
	Nuclear Repulsion Energy		167
	HOMO-LUMO Energies		167
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	167
	Internal Coordinates	x	167	x
	Products of moments of inertia		164
	Rotational Constants	x	167	x
	Point Group		168
Vibrations	Vibrational Frequencies	x	167	x
	Vibrational Intensities		148
	Zero-point energies	x	167	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
Electronic States	Electronic states		0
Electrostatics	Atom charges		90
	Dipole		90
	Quadrupole		90
	Polarizability		91
Other results	Spin		4
	Number of basis functions		20
	Diagnostics		0
	Conformations		1