CCCBDB listing of experimental data page 2

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Property	Value	Uncertainty	units	Reference
Hfg(298.15K)	-313.80	1.10	kJ mol^-1	webbook
Hfg(0K)		1.10	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	11
H-O	1
C-C	4
C-O	1

Atom 1	Atom 2
C1	H2
C1	H3
C1	H4
C1	C7
O5	H6
O5	C7
C7	H8
C7	C9
C9	H10
C9	C15
C9	H18
C11	H12
C11	H13
C11	H14
C11	C15
C15	H16
C15	H17

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	¹A	C₁	True							C₁	3	5

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	¹A	C₁	True						C₁	3	5

	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
C1	H2
C1	H3
C1	H4
C1	C7
O5	H6
O5	C7
C7	H8
C7	C9
C9	H10
C9	C15
C9	H18
C11	H12
C11	H13
C11	H14
C11	C15
C15	H16
C15	H17

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Atom 1	Atom 2
C1	H2
C1	H3
C1	H4
C1	C7
O5	H6
O5	C7
C7	H8
C7	C9
C9	H10
C9	C15
C9	H18
C11	H12
C11	H13
C11	H14
C11	C15
C15	H16
C15	H17

Experimental data for C5H12O (2-Pentanol)

Experimental data for C₅H₁₂O (2-Pentanol)

Atom 1	Atom 2
C1	H2
C1	H3
C1	H4
C1	C7
O5	H6
O5	C7
C7	H8
C7	C9
C9	H10
C9	C15
C9	H18
C11	H12
C11	H13
C11	H14
C11	C15
C15	H16
C15	H17