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	hartrees
Energy at 0K	-139.072661
Energy at 298.15K	-139.073936
HF Energy	-139.072661
Nuclear repulsion energy	32.259253

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3167	3027	12.04
2	A'	1488	1422	5.32
3	A'	1215	1161	132.69
4	A'	597	570	42.74
5	A"	3318	3171	4.63
6	A"	1192	1140	9.15

Atom	x (Å)	y (Å)	z (Å)
C1	0.028	0.653	0.000
F2	0.028	-0.681	0.000
H3	-0.207	1.104	0.952
H4	-0.207	1.104	-0.952

	C1	F2	H3	H4
C1		1.3343	1.0786	1.0786
F2	1.3343		2.0360	2.0360
H3	1.0786	2.0360		1.9038
H4	1.0786	2.0360	1.9038

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	114.664		F2	C1	H4	114.664
H3	C1	H4	123.886

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

using model chemistry: M06-2X/aug-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	-0.669
2	F	-0.251
3	H	0.460
4	H	0.460

	x	y	z	Total
	-0.406	1.338	0.000	1.398
CHELPG
AIM
ESP

	x	y	z
x	2.268	-0.029	0.000
y	-0.029	2.515	0.000
z	0.000	0.000	2.331

<r²>	18.355
(<r²>)^1/2	4.284

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

using model chemistry: M06-2X/aug-cc-pVTZ

States and conformations

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