CCCBDB listing of experimental data page 2

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Property	Value	Uncertainty	units	Reference	Comment
Hfg(298.15K)	-691.00	10.00	kJ mol^-1	webbook
Hfg(0K)		10.00	kJ mol^-1	webbook

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	3005		2000McK:8995-9008
2	A	2986
3	A	2978
4	A	1465
5	A	1433
6	A	1373
7	A	1319
8	A	1250
9	A	1155
10	A	1125
11	A	1100
12	A	1076
13	A	905
14	A	577
15	A	476
16	A	426
17	A	247
18	A	117

Bond Type	Count
C-C	1
H-C	3
C-F	3

Atom 1	Atom 2
C1	C2
C1	F3
C1	H6
C1	H7
C2	F4
C2	F5
C2	H8

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				1.580	NSRDS-NBS10	F3-C1-C2-H8 = 60 degrees MW	C₁	3	5
1	2	¹A^'	C_s					2.840	1991Mey/Mor:3860	all HCCF = 180 degrees DT	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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squib	reference	DOI
1991Mey/Mor:3860	CW Meyer, G Morrison "Dipole Moments of Seven Partially Halogenated Ethane Refrigerants" J. Phys. Chem. 1991, 95, 3860-3866	10.1021/j100162a077
2000McK:8995-9008	DC McKean "Quantum-Chemical Studies of Fluoroethanes: Vibrational Assignments, Isolated CH Stretching frequncies, Valence Force Constants, and Bond Length Relationships" J. Phys. Chem. A 2000, 104, 8995-9008	10.1021/jp001605k
NSRDS-NBS10	R. D. Nelson Jr., D. R. Lide, A. A. Maryott "Selected Values of electric dipole moments for molecules in the gas phase" NSRDS-NBS10, 1967	10.6028/NBS.NSRDS.10
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Experimental data for CHF2CH2F (Ethane, 1,1,2-trifluoro)

Experimental data for CHF₂CH₂F (Ethane, 1,1,2-trifluoro)