CCCBDB listing of experimental data page 2

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Property	Value	units	Reference
Hfg(298.15K)	264.85	kJ mol^-1	webbook
Hfg(0K)		kJ mol^-1	webbook
Entropy (298.15K)		J K^-1 mol^-1
Integrated Heat Capacity (0 to 298.15K)		kJ mol^-1

Bond Type	Count
H-C	8
C-C	2
C=C	3

Atom 1	Atom 2
H1	C7
H2	C7
H3	C7
H4	C8
H5	C8
H6	C8
C7	C13
C8	C14
H9	C13
H10	C14
C11	C12
C11	C14
C12	C13

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							C_2v	1	2

State	Config	State description	Conf description	Exp. min.	Quadrupole (D Å)			Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	xx	yy	zz	Reference	comment	Point Group	dipole	quadrupole
1	1	¹A₁	C_2v	True						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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Atom 1	Atom 2
H1	C7
H2	C7
H3	C7
H4	C8
H5	C8
H6	C8
C7	C13
C8	C14
H9	C13
H10	C14
C11	C12
C11	C14
C12	C13

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Atom 1	Atom 2
H1	C7
H2	C7
H3	C7
H4	C8
H5	C8
H6	C8
C7	C13
C8	C14
H9	C13
H10	C14
C11	C12
C11	C14
C12	C13

Experimental data for C6H8 ((Z)-hexa-2,3,4-triene)

Experimental data for C₆H₈ ((Z)-hexa-2,3,4-triene)

Atom 1	Atom 2
H1	C7
H2	C7
H3	C7
H4	C8
H5	C8
H6	C8
C7	C13
C8	C14
H9	C13
H10	C14
C11	C12
C11	C14
C12	C13