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	hartrees
Energy at 0K	-139.099832
Energy at 298.15K	-139.100994
HF Energy	-139.099832
Nuclear repulsion energy	31.834120

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3052	3036	11.45
2	A'	1419	1411	2.93
3	A'	1116	1110	115.85
4	A'	465	462	57.38
5	A"	3211	3193	6.59
6	A"	1133	1127	6.11

Atom	x (Å)	y (Å)	z (Å)
C1	0.023	0.664	0.000
F2	0.023	-0.691	0.000
H3	-0.175	1.119	0.965
H4	-0.175	1.119	-0.965

	C1	F2	H3	H4
C1		1.3551	1.0854	1.0854
F2	1.3551		2.0610	2.0610
H3	1.0854	2.0610		1.9305
H4	1.0854	2.0610	1.9305

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	114.786		F2	C1	H4	114.786
H3	C1	H4	125.558

All results from a given calculation for CH₂F (fluoromethyl radical)

using model chemistry: BLYP/6-311+G(3df,2p)

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	-0.121
2	F	-0.230
3	H	0.176
4	H	0.176

	x	y	z	Total
	-0.367	1.229	0.000	1.283
CHELPG
AIM
ESP

	x	y	z
x	2.380	-0.016	0.000
y	-0.016	2.693	0.000
z	0.000	0.000	2.361

<r²>	18.781
(<r²>)^1/2	4.334

All results from a given calculation for CH2F (fluoromethyl radical)

using model chemistry: BLYP/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₂F (fluoromethyl radical)