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	hartrees
Energy at 0K	-139.104587
Energy at 298.15K	-139.105752
HF Energy	-139.104587
Nuclear repulsion energy	31.778565

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3058	3047	12.04
2	A'	1418	1413	3.10
3	A'	1112	1108	119.74
4	A'	469	467	54.68
5	A"	3212	3201	6.83
6	A"	1130	1126	6.27

Atom	x (Å)	y (Å)	z (Å)
C1	0.024	0.666	0.000
F2	0.024	-0.693	0.000
H3	-0.176	1.120	0.965
H4	-0.176	1.120	-0.965

	C1	F2	H3	H4
C1		1.3584	1.0853	1.0853
F2	1.3584		2.0632	2.0632
H3	1.0853	2.0632		1.9304
H4	1.0853	2.0632	1.9304

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	114.740		F2	C1	H4	114.740
H3	C1	H4	125.585

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

using model chemistry: BLYP/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	-0.348
2	F	-0.300
3	H	0.324
4	H	0.324

	x	y	z	Total
	-0.361	1.206	0.000	1.259
CHELPG
AIM
ESP

	x	y	z
x	2.545	-0.028	0.000
y	-0.028	2.831	0.000
z	0.000	0.000	2.548

<r²>	18.838
(<r²>)^1/2	4.340

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

using model chemistry: BLYP/aug-cc-pVTZ

States and conformations

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