CCCBDB listing of experimental data page 2

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Property	Value	units	Reference
Hfg(298.15K)	18.19	kJ mol^-1	TRC
Hfg(0K)		kJ mol^-1	TRC
Entropy (298.15K)	328.00	J K^-1 mol^-1	TRC
Heat Capacity (298.15K)	88.04	J K^-1 mol^-1	TRC

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_g	1707		webbook
2	A_g	1186
3	A_g	632
4	A_g	425
5	A_g	288
6	A_u	333
7	A_u	140
8	B_g	529
9	B_u	1190
10	B_u	892
11	B_u	426
12	B_u	175

Bond Type	Count
C=C	1
C-F	2
C-Cl	2

Atom 1	Atom 2
C1	C2
C1	F3
C1	Cl5
C2	F4
C2	Cl6

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_G	C_2h	True							C_2h	0	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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squib	reference	DOI
TRC	Frenkel, M; Marsh, K.N.; Wilhoit, R.C.; Kabo, G.J.; Roganov, G.N.,Thermodynamics of Organic Compounds in the Gas State,Thermodynamics Research Center, College Station, TX, 1994
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Experimental data for CFClCClF (trans-1,2-dichloro-1,2-difluoroethylene)