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	hartrees
Energy at 0K	-238.758642
Energy at 298.15K	-238.761482
HF Energy	-238.758642
Nuclear repulsion energy	77.307096

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	2930	51.36	102.37	0.11	0.21
2	A₁	1573	1496	3.90	8.90	0.74	0.85
3	A₁	1157	1100	101.03	4.34	0.23	0.38
4	A₁	528	502	4.49	1.69	0.74	0.85
5	A₂	1286	1223	0.00	14.22	0.75	0.86
6	B₁	3147	2993	71.41	48.31	0.75	0.86
7	B₁	1203	1144	19.89	2.45	0.75	0.86
8	B₂	1506	1432	48.00	5.64	0.75	0.86
9	B₂	1164	1107	208.35	3.30	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.496
H2	-0.909	0.000	1.108
H3	0.909	0.000	1.108
F4	0.000	1.102	-0.289
F5	0.000	-1.102	-0.289

	C1	H2	H3	F4	F5
C1		1.0955	1.0955	1.3530	1.3530
H2	1.0955		1.8178	1.9977	1.9977
H3	1.0955	1.8178		1.9977	1.9977
F4	1.3530	1.9977	1.9977		2.2044
F5	1.3530	1.9977	1.9977	2.2044

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	112.124	H2	C1	F4	108.894
H2	C1	F5	108.894	H3	C1	F4	108.894
H3	C1	F5	108.894	F4	C1	F5	109.099

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

using model chemistry: HSEh1PBE/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	0.268
2	H	0.149
3	H	0.149
4	F	-0.283
5	F	-0.283

	x	y	z	Total
	0.000	0.000	1.719	1.719
CHELPG
AIM
ESP

<r²>	38.957
(<r²>)^1/2	6.242

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

using model chemistry: HSEh1PBE/6-31G*

States and conformations

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