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	hartrees
Energy at 0K	-238.356764
Energy at 298.15K	-238.357964
HF Energy	-238.356764
Nuclear repulsion energy	69.078472

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3006	2994	33.52
2	A'	1104	1100	86.97
3	A'	959	955	7.47
4	A'	519	517	3.39
5	A"	1289	1284	39.48
6	A"	1103	1099	235.12

Atom	x (Å)	y (Å)	z (Å)
C1	0.031	0.517	0.000
H2	-0.742	1.297	0.000
F3	0.031	-0.244	1.115
F4	0.031	-0.244	-1.115

	C1	H2	F3	F4
C1		1.0985	1.3501	1.3501
H2	1.0985		2.0535	2.0535
F3	1.3501	2.0535		2.2303
F4	1.3501	2.0535	2.2303

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	113.597		H2	C1	F4	113.597
F3	C1	F4	111.372

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

using model chemistry: BLYP/6-311G**

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	0.223
2	H	0.103
3	F	-0.163
4	F	-0.163

	x	y	z	Total
	-0.747	1.065	0.000	1.301
CHELPG
AIM
ESP

	x	y	z
x	1.518	-0.250	0.000
y	-0.250	1.898	0.000
z	0.000	0.000	2.239

<r²>	37.212
(<r²>)^1/2	6.100

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

using model chemistry: BLYP/6-311G**

States and conformations

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