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

All data (experiment and calculated) in the CCCBDB for CuH (Copper monohydride)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		189
	Energy 298.15K		4
	Atomization Enthalpy 298.15K		3
	Atomization Enthalpy 0K		161
	Entropy (298.15K)		0
	Entropy at any temperature		0
	Integrated Heat Capacity		0
	Heat Capacity (Cp)		0
	Nuclear Repulsion Energy		185
	HOMO-LUMO Energies		11
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	185
	Internal Coordinates	x	185	x
	Products of moments of inertia	x	183	x
	Rotational Constants	x	185	x
	Point Group		186
Vibrations	Vibrational Frequencies	x	185	x
	Vibrational Intensities		169
	Zero-point energies	x	185	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		111
	Dipole		111
	Quadrupole		111
	Polarizability		98
Other results	Spin		0
	Number of basis functions		17
	Diagnostics		0
	Conformations		1