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	hartrees
Energy at 0K	-138.973949
Energy at 298.15K	-138.975117
HF Energy	-138.973949
Nuclear repulsion energy	31.974278

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3056	3035	12.47
2	A'	1420	1410	3.65
3	A'	1164	1156	100.80
4	A'	464	461	51.06
5	A"	3211	3189	12.64
6	A"	1132	1125	5.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.024	0.658	0.000
F2	0.024	-0.688	0.000
H3	-0.176	1.121	0.965
H4	-0.176	1.121	-0.965

	C1	F2	H3	H4
C1		1.3452	1.0888	1.0888
F2	1.3452		2.0593	2.0593
H3	1.0888	2.0593		1.9298
H4	1.0888	2.0593	1.9298

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	115.169		F2	C1	H4	115.169
H3	C1	H4	124.807

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

using model chemistry: PBEPBEultrafine/cc-pVTZ

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	-0.008
2	F	-0.142
3	H	0.075
4	H	0.075

	x	y	z	Total
	-0.343	1.111	0.000	1.162
CHELPG
AIM
ESP

	x	y	z
x	1.655	-0.077	0.000
y	-0.077	2.326	0.000
z	0.000	0.000	2.135

<r²>	18.492
(<r²>)^1/2	4.300

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

using model chemistry: PBEPBEultrafine/cc-pVTZ

States and conformations

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