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	hartrees
Energy at 0K	-237.963660
Energy at 298.15K	-237.966578
HF Energy	-237.963660
Nuclear repulsion energy	78.482454

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3282	2968	59.24	95.43	0.12	0.21
2	A₁	1694	1532	5.05	6.47	0.75	0.86
3	A₁	1233	1115	151.48	3.64	0.27	0.43
4	A₁	583	527	7.60	1.45	0.71	0.83
5	A₂	1421	1285	0.00	10.61	0.75	0.86
6	B₁	3354	3034	69.77	41.70	0.75	0.86
7	B₁	1303	1179	36.33	1.41	0.75	0.86
8	B₂	1634	1478	52.77	3.94	0.75	0.86
9	B₂	1238	1120	281.55	3.63	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.493
H2	-0.899	0.000	1.089
H3	0.899	0.000	1.089
F4	0.000	1.083	-0.285
F5	0.000	-1.083	-0.285

	C1	H2	H3	F4	F5
C1		1.0782	1.0782	1.3343	1.3343
H2	1.0782		1.7976	1.9674	1.9674
H3	1.0782	1.7976		1.9674	1.9674
F4	1.3343	1.9674	1.9674		2.1667
F5	1.3343	1.9674	1.9674	2.1667

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	112.939	H2	C1	F4	108.810
H2	C1	F5	108.810	H3	C1	F4	108.810
H3	C1	F5	108.810	F4	C1	F5	108.575

All results from a given calculation for CH₂F₂ (Methane, difluoro-)

using model chemistry: HF/6-311G*

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	0.256
2	H	0.180
3	H	0.180
4	F	-0.307
5	F	-0.307

	x	y	z	Total
	0.000	0.000	2.153	2.153
CHELPG
AIM
ESP	0.014	0.000	2.193	2.193

<r²>	38.229
(<r²>)^1/2	6.183

All results from a given calculation for CH2F2 (Methane, difluoro-)

using model chemistry: HF/6-311G*

States and conformations

All results from a given calculation for CH₂F₂ (Methane, difluoro-)