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	hartrees
Energy at 0K	-138.460531
Energy at 298.15K	-138.461943
HF Energy	-138.460531
Nuclear repulsion energy	32.518180

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3261	3261	20.26
2	A'	1590	1590	6.65
3	A'	1257	1257	159.68
4	A'	913	913	18.63
5	A"	3403	3403	17.17
6	A"	1280	1280	11.73

Atom	x (Å)	y (Å)	z (Å)
C1	0.036	0.650	0.000
F2	0.036	-0.674	0.000
H3	-0.268	1.081	0.934
H4	-0.268	1.081	-0.934

	C1	F2	H3	H4
C1		1.3243	1.0725	1.0725
F2	1.3243		2.0112	2.0112
H3	1.0725	2.0112		1.8679
H4	1.0725	2.0112	1.8679

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	C1	H3	113.681		F2	C1	H4	113.681
H3	C1	H4	121.114

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

using model chemistry: ROHF/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	-0.519
2	F	-0.362
3	H	0.440
4	H	0.440

	x	y	z	Total
	-0.506	1.488	0.000	1.572
CHELPG
AIM
ESP

<r²>	18.045
(<r²>)^1/2	4.248

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

using model chemistry: ROHF/aug-cc-pVTZ

States and conformations

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