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
1	A	3530		webbook				Ar matrix
2	A	1347
3	A	821
4	A	509
5	A	346
6	B	3530
7	B	1359
8	B	776
9	B	387

Description	Value	unc.	Connectivity				Reference	Comment
Description	Value	unc.	Atom 1	Atom 2	Atom 3	Atom 4	Reference	Comment
rOO	1.428		1	2			2005Sum/Sum:14998
rOH	0.963		2	4			2005Sum/Sum:14998
aOOO	107		2	1	3		2005Sum/Sum:14998
aHOO	101.1		1	2	4		2005Sum/Sum:14998
dHOOO	81.8		2	1	3	5	2005Sum/Sum:14998

Atom	x (Å)	y (Å)	z (Å)
O1	0.0000	0.0000	0.6049
O2	0.0000	1.1479	-0.2445
O3	0.0000	-1.1479	-0.2445
H4	-0.9353	1.2168	-0.4632
H5	0.9353	-1.2168	-0.4632

	O1	O2	O3	H4	H5
O1		1.4280	1.4280	1.8698	1.8698
O2	1.4280		2.2958	0.9630	2.5523
O3	1.4280	2.2958		2.5523	0.9630
H4	1.8698	0.9630	2.5523		3.0694
H5	1.8698	2.5523	0.9630	3.0694

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	O2	H4	101.100		O1	O3	H5	101.100
O2	O1	O3	107.000

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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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	C₂	True							C₂	1	3

squib	reference	DOI
2005Sum/Sum:14998	K Suma, Y Sumiyoshi, Y Endo "The rotationla Spectrum and Structure of HOOOH" J. Am. Chem. Soc. 2005, 127, 14998-14999	10.1021/ja0556530
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

Bond Type	Count
O-O	2
H-O	2

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Experimental data for H2O3 (Hydrogen trioxide)

Experimental data for H₂O₃ (Hydrogen trioxide)