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	hartrees
Energy at 0K	-238.908749
Energy at 298.15K	-238.911590
HF Energy	-238.908749
Nuclear repulsion energy	77.271206

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	3081	2922	51.40	103.89	0.12	0.21
2	A₁	1581	1500	4.09	8.87	0.74	0.85
3	A₁	1154	1095	104.38	4.36	0.24	0.39
4	A₁	528	501	4.67	1.68	0.73	0.85
5	A₂	1294	1227	0.00	14.14	0.75	0.86
6	B₁	3150	2988	72.64	48.97	0.75	0.86
7	B₁	1208	1146	21.16	2.38	0.75	0.86
8	B₂	1515	1437	46.82	5.59	0.75	0.86
9	B₂	1158	1098	213.95	3.30	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.497
H2	-0.909	0.000	1.106
H3	0.909	0.000	1.106
F4	0.000	1.103	-0.289
F5	0.000	-1.103	-0.289

	C1	H2	H3	F4	F5
C1		1.0944	1.0944	1.3541	1.3541
H2	1.0944		1.8181	1.9972	1.9972
H3	1.0944	1.8181		1.9972	1.9972
F4	1.3541	1.9972	1.9972		2.2057
F5	1.3541	1.9972	1.9972	2.2057

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	112.322	H2	C1	F4	108.850
H2	C1	F5	108.850	H3	C1	F4	108.850
H3	C1	F5	108.850	F4	C1	F5	109.068

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

using model chemistry: wB97X-D/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	0.284
2	H	0.148
3	H	0.148
4	F	-0.291
5	F	-0.291

	x	y	z	Total
	0.000	0.000	1.782	1.782
CHELPG
AIM
ESP

<r²>	38.969
(<r²>)^1/2	6.242

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

using model chemistry: wB97X-D/6-31G*

States and conformations

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