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

All data (experiment and calculated) in the CCCBDB for SF₂ (sulfur difluoride)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		211
	Energy 298.15K		190
	Atomization Enthalpy 298.15K	x	179	x
	Atomization Enthalpy 0K	x	185	x
	Entropy (298.15K)	x	171	x
	Entropy at any temperature		171
	Integrated Heat Capacity	x	171	x
	Heat Capacity (Cp)	x	171	x
	Nuclear Repulsion Energy		188
	HOMO-LUMO Energies		181
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	188
	Internal Coordinates	x	188	x
	Products of moments of inertia	x	184	x
	Rotational Constants	x	188	x
	Point Group		189
Vibrations	Vibrational Frequencies	x	187	x
	Vibrational Intensities		180
	Zero-point energies	x	187	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants		4
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		176
	Dipole	x	114	x
	Quadrupole		113
	Polarizability		114
Other results	Spin		12
	Number of basis functions		32
	Diagnostics		6
	Conformations		1