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	hartrees
Energy at 0K	-139.057185
Energy at 298.15K	-139.058391
HF Energy	-139.057185
Nuclear repulsion energy	31.916035

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3070	3026	14.56
2	A'	1443	1422	4.32
3	A'	1138	1121	116.10
4	A'	515	508	52.57
5	A"	3226	3180	16.56
6	A"	1152	1135	6.32

Atom	x (Å)	y (Å)	z (Å)
C1	0.026	0.661	0.000
F2	0.026	-0.689	0.000
H3	-0.194	1.116	0.962
H4	-0.194	1.116	-0.962

	C1	F2	H3	H4
C1		1.3503	1.0861	1.0861
F2	1.3503		2.0565	2.0565
H3	1.0861	2.0565		1.9234
H4	1.0861	2.0565	1.9234

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	114.716		F2	C1	H4	114.716
H3	C1	H4	124.625

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

using model chemistry: B97D3/TZVP

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	-0.068
2	F	-0.172
3	H	0.120
4	H	0.120

	x	y	z	Total
	-0.413	1.316	0.000	1.379
CHELPG
AIM
ESP

	x	y	z
x	1.601	-0.079	0.000
y	-0.079	2.245	0.000
z	0.000	0.000	1.983

<r²>	18.517
(<r²>)^1/2	4.303

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

using model chemistry: B97D3/TZVP

States and conformations

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