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	hartrees
Energy at 0K	-475.295196
Energy at 298.15K	-475.296064
HF Energy	-475.295196
Nuclear repulsion energy	241.608030

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1852	1820	0.00
2	A_g	764	751	0.00
3	A_g	384	377	0.00
4	A_u	187	184	0.00
5	B_1u	1142	1123	372.16
6	B_1u	531	521	2.43
7	B_2g	465	457	0.00
8	B_2u	1278	1256	462.97
9	B_2u	204	200	4.64
10	B_3g	1277	1255	0.00
11	B_3g	528	519	0.00
12	B_3u	394	387	3.03

Atom	y (Å)	z (Å)
C1	0.000	0.668
C2	0.000	-0.668
F3	1.115	1.400
F4	-1.115	1.400
F5	-1.115	-1.400
F6	1.115	-1.400

	C1	C2	F3	F4	F5	F6
C1		1.3364	1.3338	1.3338	2.3496	2.3496
C2	1.3364		2.3496	2.3496	1.3338	1.3338
F3	1.3338	2.3496		2.2303	3.5795	2.7998
F4	1.3338	2.3496	2.2303		2.7998	3.5795
F5	2.3496	1.3338	3.5795	2.7998		2.2303
F6	2.3496	1.3338	2.7998	3.5795	2.2303

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	121.094	C1	C2	F6	121.094
C2	C1	F3	121.094	C2	C1	F4	121.094
F3	C1	F4	117.811	F5	C2	F6	117.811

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)

using model chemistry: B97D3/6-31+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
1	C	0.537
2	C	0.537
3	F	-0.269
4	F	-0.269
5	F	-0.269
6	F	-0.269

<r²>	140.361
(<r²>)^1/2	11.847

All results from a given calculation for C2F4 (Tetrafluoroethylene)

using model chemistry: B97D3/6-31+G**

States and conformations

All results from a given calculation for C₂F₄ (Tetrafluoroethylene)