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	hartrees
Energy at 0K	-276.778758
Energy at 298.15K	-276.781270
HF Energy	-276.778758
Nuclear repulsion energy	117.801495

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3250	3089	6.12
2	A₁	1828	1737	282.40
3	A₁	1428	1357	2.26
4	A₁	969	921	66.95
5	A₁	552	524	4.37
6	A₂	728	692	0.00
7	B₁	815	774	91.00
8	B₁	642	610	2.12
9	B₂	3351	3185	0.06
10	B₂	1388	1319	229.68
11	B₂	975	927	10.64
12	B₂	438	416	0.94

Atom	y (Å)	z (Å)
C1	0.000	1.382
C2	0.000	0.062
H3	0.938	1.921
H4	-0.938	1.921
F5	1.079	-0.695
F6	-1.079	-0.695

	C1	C2	H3	H4	F5	F6
C1		1.3204	1.0811	1.0811	2.3406	2.3406
C2	1.3204		2.0818	2.0818	1.3178	1.3178
H3	1.0811	2.0818		1.8752	2.6191	3.3025
H4	1.0811	2.0818	1.8752		3.3025	2.6191
F5	2.3406	1.3178	2.6191	3.3025		2.1581
F6	2.3406	1.3178	3.3025	2.6191	2.1581

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	125.036	C1	C2	F6	125.036
C2	C1	H3	119.860	C2	C1	H4	119.860
H3	C1	H4	120.279	F5	C2	F6	109.927

All results from a given calculation for CH₂CF₂ (Ethene, 1,1-difluoro-)

using model chemistry: PBE1PBE/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	-0.524
2	C	0.606
3	H	0.201
4	H	0.201
5	F	-0.242
6	F	-0.242

	x	y	z	Total
	0.000	0.000	0.992	0.992
CHELPG
AIM
ESP

<r²>	63.432
(<r²>)^1/2	7.964

All results from a given calculation for CH2CF2 (Ethene, 1,1-difluoro-)

using model chemistry: PBE1PBE/6-31G*

States and conformations

All results from a given calculation for CH₂CF₂ (Ethene, 1,1-difluoro-)