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	hartrees
Energy at 0K	-468.759577
Energy at 298.15K	-468.759964
Nuclear repulsion energy	234.118723

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1806	1612	0.00
2	A_g	784	700	0.00
3	A_g	353	315	0.00
4	A_u	174	155	0.00
5	B_1u	1214	1083	125.39
6	B_1u	496	443	2.01
7	B_2g	387	346	0.00
8	B_2u	1397	1246	115.06
9	B_2u	173	155	1.25
10	B_3g	1459	1302	0.00
11	B_3g	521	465	0.00
12	B_3u	391	349	0.72

Atom	y (Å)	z (Å)
C1	0.000	0.689
C2	0.000	-0.689
F3	1.152	1.443
F4	-1.152	1.443
F5	-1.152	-1.443
F6	1.152	-1.443

	C1	C2	F3	F4	F5	F6
C1		1.3778	1.3770	1.3770	2.4233	2.4233
C2	1.3778		2.4233	2.4233	1.3770	1.3770
F3	1.3770	2.4233		2.3043	3.6932	2.8861
F4	1.3770	2.4233	2.3043		2.8861	3.6932
F5	2.4233	1.3770	3.6932	2.8861		2.3043
F6	2.4233	1.3770	2.8861	3.6932	2.3043

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	123.208	C1	C2	F6	123.208
C2	C1	F3	123.208	C2	C1	F4	123.208
F3	C1	F4	113.584	F5	C2	F6	113.584

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)

using model chemistry: B3LYP/STO-3G

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	0.118
2	C	0.118
3	F	-0.059
4	F	-0.059
5	F	-0.059
6	F	-0.059

<r²>	145.041
(<r²>)^1/2	12.043

All results from a given calculation for C2F4 (Tetrafluoroethylene)

using model chemistry: B3LYP/STO-3G

States and conformations

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)