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	hartrees
Energy at 0K	-238.233642
Energy at 298.15K	-238.234916
HF Energy	-238.233642
Nuclear repulsion energy	70.732595

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3169	3018	32.02
2	A'	1239	1180	86.14
3	A'	1027	978	12.23
4	A'	562	535	4.43
5	A"	1396	1329	120.40
6	A"	1258	1198	134.89

Atom	x (Å)	y (Å)	z (Å)
C1	0.030	0.502	0.000
H2	-0.719	1.296	0.000
F3	0.030	-0.239	1.087
F4	0.030	-0.239	-1.087

	C1	H2	F3	F4
C1		1.0910	1.3165	1.3165
H2	1.0910		2.0251	2.0251
F3	1.3165	2.0251		2.1750
F4	1.3165	2.0251	2.1750

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	114.202		H2	C1	F4	114.202
F3	C1	F4	111.390

All results from a given calculation for CHF₂ (difluoromethyl radical)

using model chemistry: M06-2X/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	0.060
2	H	0.132
3	F	-0.096
4	F	-0.096

	x	y	z	Total
	-0.602	1.074	0.000	1.231
CHELPG
AIM
ESP

	x	y	z
x	1.686	-0.263	0.000
y	-0.263	2.026	0.000
z	0.000	0.000	2.177

<r²>	35.685
(<r²>)^1/2	5.974

All results from a given calculation for CHF2 (difluoromethyl radical)

using model chemistry: M06-2X/6-31G(2df,p)

States and conformations

All results from a given calculation for CHF₂ (difluoromethyl radical)