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	hartrees
Energy at 0K	-139.075321
Energy at 298.15K	-139.076583
HF Energy	-139.075321
Nuclear repulsion energy	32.256106

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3121	3012	12.45
2	A'	1487	1435	6.80
3	A'	1219	1176	92.90
4	A'	580	560	37.25
5	A"	3272	3157	17.20
6	A"	1182	1140	8.61

Atom	x (Å)	y (Å)	z (Å)
C1	0.027	0.651	0.000
F2	0.027	-0.681	0.000
H3	-0.205	1.112	0.954
H4	-0.205	1.112	-0.954

	C1	F2	H3	H4
C1		1.3313	1.0846	1.0846
F2	1.3313		2.0439	2.0439
H3	1.0846	2.0439		1.9075
H4	1.0846	2.0439	1.9075

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	115.183		F2	C1	H4	115.183
H3	C1	H4	123.128

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

using model chemistry: B3LYP/6-31G(2df,p)

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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Number	Element	Mulliken
1	C	-0.183
2	F	-0.065
3	H	0.124
4	H	0.124

	x	y	z	Total
	-0.367	1.083	0.000	1.143
CHELPG
AIM
ESP

	x	y	z
x	1.312	-0.100	0.000
y	-0.100	2.069	0.000
z	0.000	0.000	2.002

<r²>	18.086
(<r²>)^1/2	4.253

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

using model chemistry: B3LYP/6-31G(2df,p)

States and conformations

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