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	hartrees
Energy at 0K	-475.047595
Energy at 298.15K	-475.048395
Nuclear repulsion energy	241.800508

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1858	1831	0.00
2	A_g	776	765	0.00
3	A_g	379	374	0.00
4	A_u	186	183	0.00
5	B_1u	1170	1153	316.75
6	B_1u	529	522	1.44
7	B_2g	420	414	0.00
8	B_2u	1324	1305	368.37
9	B_2u	192	189	3.86
10	B_3g	1325	1306	0.00
11	B_3g	525	518	0.00
12	B_3u	399	393	1.72

Atom	y (Å)	z (Å)
C1	0.000	0.669
C2	0.000	-0.669
F3	1.117	1.395
F4	-1.117	1.395
F5	-1.117	-1.395
F6	1.117	-1.395

	C1	C2	F3	F4	F5	F6
C1		1.3383	1.3323	1.3323	2.3472	2.3472
C2	1.3383		2.3472	2.3472	1.3323	1.3323
F3	1.3323	2.3472		2.2344	3.5745	2.7901
F4	1.3323	2.3472	2.2344		2.7901	3.5745
F5	2.3472	1.3323	3.5745	2.7901		2.2344
F6	2.3472	1.3323	2.7901	3.5745	2.2344

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	123.014	C1	C2	F6	123.014
C2	C1	F3	123.014	C2	C1	F4	123.014
F3	C1	F4	113.972	F5	C2	F6	113.972

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)

using model chemistry: PBEPBE/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	C	0.408
2	C	0.408
3	F	-0.204
4	F	-0.204
5	F	-0.204
6	F	-0.204

<r²>	139.087
(<r²>)^1/2	11.794

All results from a given calculation for C2F4 (Tetrafluoroethylene)

using model chemistry: PBEPBE/6-31G*

States and conformations

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)