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	hartrees
Energy at 0K	-139.108245
Energy at 298.15K	-139.109414
HF Energy	-139.108245
Nuclear repulsion energy	31.800446

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3056	3056	11.80
2	A'	1424	1424	3.61
3	A'	1120	1120	108.58
4	A'	475	475	54.89
5	A"	3213	3213	10.56
6	A"	1133	1133	6.38

Atom	x (Å)	y (Å)	z (Å)
C1	0.024	0.665	0.000
F2	0.024	-0.692	0.000
H3	-0.179	1.120	0.965
H4	-0.179	1.120	-0.965

	C1	F2	H3	H4
C1		1.3568	1.0860	1.0860
F2	1.3568		2.0630	2.0630
H3	1.0860	2.0630		1.9293
H4	1.0860	2.0630	1.9293

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	114.795		F2	C1	H4	114.795
H3	C1	H4	125.316

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

using model chemistry: BLYP/Def2TZVPP

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	-0.058
2	F	-0.178
3	H	0.118
4	H	0.118

	x	y	z	Total
	-0.372	1.214	0.000	1.269
CHELPG
AIM
ESP

	x	y	z
x	1.870	-0.054	0.000
y	-0.054	2.441	0.000
z	0.000	0.000	2.182

<r²>	18.720
(<r²>)^1/2	4.327

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

using model chemistry: BLYP/Def2TZVPP

States and conformations

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