CCCBDB listing of experimental data page 2

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Mode Number	Symmetry	Frequency			Intensity			Comment	Description
Mode Number	Symmetry	Fundamental(cm^-1)	Harmonic(cm^-1)	Reference	(km mol^-1)	unc.	Reference	Comment	Description
3	A'	1850		2004von/Wil:2048
4	A'	1427		2004von/Wil:2048
5	A'	1372		2004von/Wil:2048
6	A'	1160		2004von/Wil:2048
7	A'	1106		2004von/Wil:2048
8	A'	977		2004von/Wil:2048
9	A'	743		2004von/Wil:2048
10	A'	545		2004von/Wil:2048
11	A'	500		2004von/Wil:2048
12	A'	348		2004von/Wil:2048
14	A"	1432		2004von/Wil:2048
15	A"	1033		2004von/Wil:2048

Bond Type	Count
C-C	1
H-C	3
C-O	1
C=O	1
O-O	1

Atom 1	Atom 2
C1	C2
C1	H6
C1	H7
C1	H8
C2	O3
C2	O4
O4	O5

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^'	C_s	True							C_s	2	3

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^'	C_s	True						C_s	2	3

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Experimental data for CH3C(O)OO (acetyl peroxy radical)

Experimental data for CH₃C(O)OO (acetyl peroxy radical)