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	hartrees
Energy at 0K	-139.128641
Energy at 298.15K	-139.129851
HF Energy	-139.128641
Nuclear repulsion energy	32.154180

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3127	3023	12.09
2	A'	1470	1421	4.45
3	A'	1185	1146	112.22
4	A'	507	490	48.63
5	A"	3285	3175	10.75
6	A"	1170	1131	7.42

Atom	x (Å)	y (Å)	z (Å)
C1	0.024	0.655	0.000
F2	0.024	-0.684	0.000
H3	-0.181	1.112	0.956
H4	-0.181	1.112	-0.956

	C1	F2	H3	H4
C1		1.3392	1.0796	1.0796
F2	1.3392		2.0453	2.0453
H3	1.0796	2.0453		1.9126
H4	1.0796	2.0453	1.9126

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	115.054		F2	C1	H4	115.054
H3	C1	H4	124.713

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

using model chemistry: B3LYPultrafine/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	0.019
2	F	-0.178
3	H	0.080
4	H	0.080

	x	y	z	Total
	-0.354	1.249	0.000	1.298
CHELPG
AIM
ESP

	x	y	z
x	1.602	-0.075	0.000
y	-0.075	2.222	0.000
z	0.000	0.000	2.049

<r²>	18.336
(<r²>)^1/2	4.282

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

using model chemistry: B3LYPultrafine/cc-pVTZ

States and conformations

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