CCCBDB listing of experimental data page 2

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Property	Value	Uncertainty	units	Reference
Hfg(298.15K)	-54.90	1.10	kJ mol^-1	webbook
Hfg(0K)		1.10	kJ mol^-1	webbook
Heat Capacity (298.15K)	120.08		J K^-1 mol^-1	webbook

Description	Value	unc.	Connectivity				Reference	Comment
Description	Value	unc.	Atom 1	Atom 2	Atom 3	Atom 4	Reference	Comment
rCC	1.536		2	4			1987Kuchitsu(II/15)
rCC	1.573		4	7			1987Kuchitsu(II/15)
rCC	1.546		1	2			1987Kuchitsu(II/15)
rCH	1.113		1	8			1987Kuchitsu(II/15)	average C-H
aCCC	102		1	2	4		1987Kuchitsu(II/15)
aCCC	93.4		2	1	3		1987Kuchitsu(II/15)
aCCC	102.7		2	4	7		1987Kuchitsu(II/15)
aCCC	109		4	2	5		1987Kuchitsu(II/15)
dCCCC	35.8		1	2	5	6	1987Kuchitsu(II/15)
dCCCC	56.3		2	1	3	6	1987Kuchitsu(II/15)
dCCCC	71.6		4	2	5	6	1987Kuchitsu(II/15)

Bond Type	Count
C-C	8
H-C	12

Atom 1	Atom 2
C1	C2
C1	C3
C1	H8
C1	H9
C2	C4
C2	C5
C2	H10
C3	C6
C3	C7
C3	H11
C4	C7
C4	H12
C4	H18
C5	C6
C5	H15
C5	H17
C6	H13
C6	H19
C7	H14
C7	H16

State	Config	State description	Conf description	Exp. min.	Dipole (Debye)				Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	x	y	z	total	Reference	comment	Point Group	dipole	quadrupole
1	1	¹A₁	C_2v	True				0.091	NISThydrocarbon		C_2v	1	2

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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You are here: Experimental > One molecule all properties

Atom 1	Atom 2
C1	C2
C1	C3
C1	H8
C1	H9
C2	C4
C2	C5
C2	H10
C3	C6
C3	C7
C3	H11
C4	C7
C4	H12
C4	H18
C5	C6
C5	H15
C5	H17
C6	H13
C6	H19
C7	H14
C7	H16

squib	reference	DOI
1987Kuchitsu(II/15)	Kuchitsu (ed.), Landolt-Bornstein: Group II: Atomic and Molecular Physics Volume 15: Structure Data of Free Polyatomic Molecules. Springer-Verlag, Berlin, 1987.
NISThydrocarbon	NIST Hydrocarbon spectral database (http://www.physics.nist.gov/PhysRefData/MolSpec/Hydro/index.html)	10.18434/T4PC70
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Atom 1	Atom 2
C1	C2
C1	C3
C1	H8
C1	H9
C2	C4
C2	C5
C2	H10
C3	C6
C3	C7
C3	H11
C4	C7
C4	H12
C4	H18
C5	C6
C5	H15
C5	H17
C6	H13
C6	H19
C7	H14
C7	H16

Experimental data for C7H12 (Norbornane)

Experimental data for C₇H₁₂ (Norbornane)

Atom 1	Atom 2
C1	C2
C1	C3
C1	H8
C1	H9
C2	C4
C2	C5
C2	H10
C3	C6
C3	C7
C3	H11
C4	C7
C4	H12
C4	H18
C5	C6
C5	H15
C5	H17
C6	H13
C6	H19
C7	H14
C7	H16