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	hartrees
Energy at 0K	-60.780113
Energy at 298.15K	-60.782421
Nuclear repulsion energy	60.851629

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3240	3157	10.49
2	A₁	1712	1668	31.53
3	A₁	1256	1224	25.77
4	A₁	947	923	60.84
5	A₁	225	219	2.84
6	A₂	863	841	0.00
7	A₂	468	456	0.00
8	B₁	773	753	65.15
9	B₂	3210	3128	3.87
10	B₂	1353	1318	15.24
11	B₂	1066	1039	108.75
12	B₂	724	705	29.76

Atom	y (Å)	z (Å)
C1	0.671	0.610
C2	-0.671	0.610
F3	1.414	-0.574
F4	-1.414	-0.574
H5	1.284	1.504
H6	-1.284	1.504

	C1	C2	F3	F4	H5	H6
C1		1.3430	1.3974	2.3980	1.0840	2.1503
C2	1.3430		2.3980	1.3974	2.1503	1.0840
F3	1.3974	2.3980		2.8278	2.0824	3.4055
F4	2.3980	1.3974	2.8278		3.4055	2.0824
H5	1.0840	2.1503	2.0824	3.4055		2.5678
H6	2.1503	1.0840	3.4055	2.0824	2.5678

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.093	C1	C2	H6	124.398
C2	C1	F3	122.093	C2	C1	H5	124.398
F3	C1	H5	113.509	F4	C2	H6	113.509

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

using model chemistry: B3LYP/CEP-121G

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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HF vs MP2 Bad vib. Calc. vs exp. 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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	0.052
2	C	0.052
3	F	-0.207
4	F	-0.207
5	H	0.155
6	H	0.155

	x	y	z	Total
	0.000	0.000	3.302	3.302
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: B3LYP/CEP-121G

States and conformations

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