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	hartrees
Energy at 0K	-138.935444
Energy at 298.15K	-138.936683
HF Energy	-138.935444
Nuclear repulsion energy	32.111686

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3175	3033	12.15
2	A'	1471	1405	6.82
3	A'	1204	1150	132.39
4	A'	551	527	55.92
5	A"	3336	3187	7.25
6	A"	1174	1121	7.18

Atom	x (Å)	y (Å)	z (Å)
C1	0.026	0.657	0.000
F2	0.026	-0.684	0.000
H3	-0.197	1.107	0.960
H4	-0.197	1.107	-0.960

	C1	F2	H3	H4
C1		1.3406	1.0835	1.0835
F2	1.3406		2.0444	2.0444
H3	1.0835	2.0444		1.9194
H4	1.0835	2.0444	1.9194

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	114.586		F2	C1	H4	114.586
H3	C1	H4	124.686

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

using model chemistry: PBE1PBE/6-31+G**

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	-0.080
2	F	-0.235
3	H	0.157
4	H	0.157

	x	y	z	Total
	-0.440	1.418	0.000	1.485
CHELPG
AIM
ESP

	x	y	z
x	1.743	-0.057	0.000
y	-0.057	2.202	0.000
z	0.000	0.000	1.935

<r²>	18.440
(<r²>)^1/2	4.294

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

using model chemistry: PBE1PBE/6-31+G**

States and conformations

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