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	hartrees
Energy at 0K	-238.907003
Energy at 298.15K	-238.909846
HF Energy	-238.907003
Nuclear repulsion energy	77.180465

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	3112	2963	39.48	111.56	0.10	0.19
2	A₁	1545	1471	1.47	6.79	0.75	0.85
3	A₁	1156	1101	115.16	5.87	0.17	0.29
4	A₁	531	505	6.56	1.46	0.70	0.83
5	A₂	1282	1221	0.00	10.04	0.75	0.86
6	B₁	3191	3039	34.20	50.72	0.75	0.86
7	B₁	1186	1130	21.16	1.51	0.75	0.86
8	B₂	1472	1401	29.51	3.97	0.75	0.86
9	B₂	1149	1094	263.49	3.46	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.506
H2	-0.915	0.000	1.102
H3	0.915	0.000	1.102
F4	0.000	1.100	-0.291
F5	0.000	-1.100	-0.291

	C1	H2	H3	F4	F5
C1		1.0917	1.0917	1.3588	1.3588
H2	1.0917		1.8291	1.9972	1.9972
H3	1.0917	1.8291		1.9972	1.9972
F4	1.3588	1.9972	1.9972		2.2008
F5	1.3588	1.9972	1.9972	2.2008

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	113.799	H2	C1	F4	108.685
H2	C1	F5	108.685	H3	C1	F4	108.685
H3	C1	F5	108.685	F4	C1	F5	108.162

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

using model chemistry: M06-2X/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	0.324
2	H	0.144
3	H	0.144
4	F	-0.306
5	F	-0.306

	x	y	z	Total
	0.000	0.000	2.154	2.154
CHELPG
AIM
ESP

<r²>	39.383
(<r²>)^1/2	6.276

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

using model chemistry: M06-2X/6-31+G**

States and conformations

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