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

All data (experiment and calculated) in the CCCBDB for C₇H₁₂ (Norbornane)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K
	Energy 0K		192
	Energy 298.15K		164
	Atomization Enthalpy 298.15K	x	148	x
	Atomization Enthalpy 0K		163
	Entropy (298.15K)		154
	Entropy at any temperature		154
	Integrated Heat Capacity		154
	Heat Capacity (Cp)	x	154	x
	Nuclear Repulsion Energy		191
	HOMO-LUMO Energies		188
	Barriers to Internal Rotation		0
Geometries	Cartesians		180
	Internal Coordinates	x	180	x
	Products of moments of inertia	x	186	x
	Rotational Constants	x	190	x
	Point Group		192
Vibrations	Vibrational Frequencies		174
	Vibrational Intensities		174
	Zero-point energies		174
	Vibrational scaling factors
	Anharmonic frequencies and constants		1
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		139
	Dipole	x	139	x
	Quadrupole		139
	Polarizability		140
Other results	Spin		0
	Number of basis functions		27
	Diagnostics		0
	Conformations		1