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	hartrees
Energy at 0K	-475.536440
Energy at 298.15K	-475.537426
Nuclear repulsion energy	243.019827

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1919	1850	0.00
2	A_g	789	761	0.00
3	A_g	391	377	0.00
4	A_u	195	188	0.00
5	B_1u	1179	1137	392.36
6	B_1u	543	523	2.92
7	B_2g	522	504	0.00
8	B_2u	1326	1278	452.66
9	B_2u	206	199	5.28
10	B_3g	1328	1281	0.00
11	B_3g	545	526	0.00
12	B_3u	405	391	4.61

Atom	y (Å)	z (Å)
C1	0.000	0.663
C2	0.000	-0.663
F3	1.108	1.392
F4	-1.108	1.392
F5	-1.108	-1.392
F6	1.108	-1.392

	C1	C2	F3	F4	F5	F6
C1		1.3261	1.3267	1.3267	2.3352	2.3352
C2	1.3261		2.3352	2.3352	1.3267	1.3267
F3	1.3267	2.3352		2.2162	3.5592	2.7850
F4	1.3267	2.3352	2.2162		2.7850	3.5592
F5	2.3352	1.3267	3.5592	2.7850		2.2162
F6	2.3352	1.3267	2.7850	3.5592	2.2162

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	123.356	C1	C2	F6	123.356
C2	C1	F3	123.356	C2	C1	F4	123.356
F3	C1	F4	113.289	F5	C2	F6	113.289

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)

using model chemistry: B3LYP/6-31+G**

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	ESP
1	C	0.580	0.259
2	C	0.580	0.259
3	F	-0.290	-0.129
4	F	-0.290	-0.129
5	F	-0.290	-0.129
6	F	-0.290	-0.129

<r²>	139.151
(<r²>)^1/2	11.796

All results from a given calculation for C2F4 (Tetrafluoroethylene)

using model chemistry: B3LYP/6-31+G**

States and conformations

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)