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	hartrees
Energy at 0K	-138.154196
Energy at 298.15K	-138.155391
HF Energy	-138.090012
Nuclear repulsion energy	31.475210

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3188	3188	6.53
2	A'	1563	1563	6.31
3	A'	1179	1179	55.15
4	A'	488	488	59.86
5	A"	3341	3341	23.76
6	A"	1185	1185	5.90

Atom	x (Å)	y (Å)	z (Å)
C1	0.022	0.673	0.000
F2	0.022	-0.704	0.000
H3	-0.167	1.150	0.949
H4	-0.167	1.150	-0.949

	C1	F2	H3	H4
C1		1.3768	1.0788	1.0788
F2	1.3768		2.0912	2.0912
H3	1.0788	2.0912		1.8976
H4	1.0788	2.0912	1.8976

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	116.249		F2	C1	H4	116.249
H3	C1	H4	123.168

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

using model chemistry: B2PLYP/3-21G

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	-0.090
2	F	-0.276
3	H	0.183
4	H	0.183

	x	y	z	Total
	-0.367	1.443	0.000	1.489
CHELPG
AIM
ESP

	x	y	z
x	0.677	-0.098	0.000
y	-0.098	1.794	0.000
z	0.000	0.000	1.550

<r²>	18.680
(<r²>)^1/2	4.322

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

using model chemistry: B2PLYP/3-21G

States and conformations

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