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	hartrees
Energy at 0K	-696.798573
Energy at 298.15K	-696.800962
Nuclear repulsion energy	169.673030

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3359	3032	30.97
2	A'	1484	1340	122.33
3	A'	1256	1134	270.50
4	A'	892	805	173.51
5	A'	647	584	10.87
6	A'	449	406	0.57
7	A"	1542	1392	50.16
8	A"	1310	1182	230.05
9	A"	399	360	1.71

Atom	x (Å)	y (Å)	z (Å)
C1	-0.564	-0.089	0.000
H2	-1.433	0.543	0.000
Cl3	0.881	0.914	0.000
F4	-0.564	-0.863	1.070
F5	-0.564	-0.863	-1.070

	C1	H2	Cl3	F4	F5
C1		1.0753	1.7589	1.3206	1.3206
H2	1.0753		2.3436	1.9697	1.9697
Cl3	1.7589	2.3436		2.5279	2.5279
F4	1.3206	1.9697	2.5279		2.1404
F5	1.3206	1.9697	2.5279	2.1404

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.176	H2	C1	F4	110.173
H2	C1	Cl5	110.173	F3	C1	F4	109.518
F3	C1	Cl5	109.518	F4	C1	Cl5	108.266

All results from a given calculation for CHF₂Cl (difluorochloromethane)

using model chemistry: HF/6-31G**

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	0.555
2	H	0.155
3	Cl	-0.048
4	F	-0.331
5	F	-0.331

	x	y	z	Total
	-1.359	0.949	0.000	1.657
CHELPG
AIM
ESP

	x	y	z
x	3.501	0.800	0.000
y	0.800	3.010	0.000
z	0.000	0.000	2.449

<r²>	89.187
(<r²>)^1/2	9.444

All results from a given calculation for CHF2Cl (difluorochloromethane)

using model chemistry: HF/6-31G**

States and conformations

All results from a given calculation for CHF₂Cl (difluorochloromethane)