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	hartrees
Energy at 0K	-276.756537
Energy at 298.15K	-276.758826
Nuclear repulsion energy	112.632224

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3168	3125	13.65
2	A₁	1733	1709	47.33
3	A₁	1259	1242	30.84
4	A₁	1011	997	50.49
5	A₁	216	213	1.75
6	A₂	791	780	0.00
7	A₂	481	474	0.00
8	B₁	756	746	34.21
9	B₂	3144	3101	0.42
10	B₂	1372	1353	30.54
11	B₂	1136	1121	98.55
12	B₂	750	740	23.92

Atom	y (Å)	z (Å)
C1	0.669	0.580
C2	-0.669	0.580
F3	1.400	-0.553
F4	-1.400	-0.553
H5	1.253	1.503
H6	-1.253	1.503

	C1	C2	F3	F4	H5	H6
C1		1.3384	1.3480	2.3587	1.0927	2.1329
C2	1.3384		2.3587	1.3480	2.1329	1.0927
F3	1.3480	2.3587		2.7992	2.0615	3.3567
F4	2.3587	1.3480	2.7992		3.3567	2.0615
H5	1.0927	2.1329	2.0615	3.3567		2.5069
H6	2.1329	1.0927	3.3567	2.0615	2.5069

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.809	C1	C2	H6	122.323
C2	C1	F3	122.809	C2	C1	H5	122.323
F3	C1	H5	114.868	F4	C2	H6	114.868

All results from a given calculation for C₂H₂F₂ (Ethene, 1,2-difluoro-, (Z)-)

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	0.114
2	C	0.114
3	F	-0.230
4	F	-0.230
5	H	0.116
6	H	0.116

	x	y	z	Total
	0.000	0.000	1.927	1.927
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2H2F2 (Ethene, 1,2-difluoro-, (Z)-)

using model chemistry: PBEPBE/6-31G**

States and conformations

All results from a given calculation for C₂H₂F₂ (Ethene, 1,2-difluoro-, (Z)-)