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	hartrees
Energy at 0K	-139.076605
Energy at 298.15K	-139.077898
HF Energy	-139.076605
Nuclear repulsion energy	32.151600

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3112	3003	13.96
2	A'	1490	1438	6.74
3	A'	1205	1162	93.55
4	A'	637	615	34.25
5	A"	3262	3148	22.14
6	A"	1183	1142	7.88

Atom	x (Å)	y (Å)	z (Å)
C1	-0.031	0.720	0.000
F2	-0.031	-0.704	0.000
H3	0.234	1.006	0.994
H4	0.234	1.006	-0.994

	C1	F2	H3	H4
C1		1.4238	1.0676	1.0676
F2	1.4238		1.9950	1.9950
H3	1.0676	1.9950		1.9877
H4	1.0676	1.9950	1.9877

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	105.514		F2	C1	H4	105.514
H3	C1	H4	137.172

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

using model chemistry: TPSSh/6-31G(2df,p)

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	-0.199
2	F	-0.088
3	H	0.144
4	H	0.144

	x	y	z	Total
	0.404	1.092	0.000	1.164
CHELPG
AIM
ESP

	x	y	z
x	1.335	-0.108	0.000
y	-0.108	2.096	0.000
z	0.000	0.000	2.030

<r²>	18.115
(<r²>)^1/2	4.256

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

using model chemistry: TPSSh/6-31G(2df,p)

States and conformations

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