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
8	A₁	363		webbook
17	B₁	153		webbook

Bond Type	Count
C-C	2
C=S	1
H-C	6

Atom 1	Atom 2
C1	S2
C1	C3
C1	C4
C3	H5
C3	H7
C3	H8
C4	H6
C4	H9
C4	H10

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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squib	reference	DOI
1974Kro/Lan:265	HW Kroto, BM Landsberg, RJ Suffolk, A Vodden "The photoelectron and microwave spectra of the unstable species thioacetaldehyde, CH3CHS, and tioacetone, (CH3)2CS" Chemical Physics Letters 29 (2), 265, 1974	10.1016/0009-2614(74)85029-3
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Experimental data for CH3CSCH3 (Thioacetone)

Experimental data for CH₃CSCH₃ (Thioacetone)