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	hartrees
Energy at 0K	-475.194227
Energy at 298.15K	-475.195124
Nuclear repulsion energy	242.260753

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1844	1825	0.00
2	A_g	768	760	0.00
3	A_g	385	381	0.00
4	A_u	188	186	0.00
5	B_1u	1150	1138	360.51
6	B_1u	535	530	1.52
7	B_2g	487	482	0.00
8	B_2u	1286	1273	420.60
9	B_2u	197	195	4.62
10	B_3g	1285	1271	0.00
11	B_3g	530	525	0.00
12	B_3u	404	399	1.94

Atom	y (Å)	z (Å)
C1	0.000	0.667
C2	0.000	-0.667
F3	1.112	1.396
F4	-1.112	1.396
F5	-1.112	-1.396
F6	1.112	-1.396

	C1	C2	F3	F4	F5	F6
C1		1.3345	1.3297	1.3297	2.3438	2.3438
C2	1.3345		2.3438	2.3438	1.3297	1.3297
F3	1.3297	2.3438		2.2247	3.5697	2.7917
F4	1.3297	2.3438	2.2247		2.7917	3.5697
F5	2.3438	1.3297	3.5697	2.7917		2.2247
F6	2.3438	1.3297	2.7917	3.5697	2.2247

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	123.225	C1	C2	F6	123.225
C2	C1	F3	123.225	C2	C1	F4	123.225
F3	C1	F4	113.550	F5	C2	F6	113.550

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)

using model chemistry: PBEPBE/6-311G*

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	0.286
2	C	0.286
3	F	-0.143
4	F	-0.143
5	F	-0.143
6	F	-0.143

<r²>	139.308
(<r²>)^1/2	11.803

All results from a given calculation for C2F4 (Tetrafluoroethylene)

using model chemistry: PBEPBE/6-311G*

States and conformations

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)