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	hartrees
Energy at 0K	-707.931709
Energy at 298.15K	-707.933267
HF Energy	-707.931709
Nuclear repulsion energy	187.999115

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1052	1036	63.28
2	A'	609	600	161.64
3	A'	492	485	37.18
4	A'	347	341	1.27
5	A"	1192	1175	200.70
6	A"	292	288	6.98

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.345	0.152	0.000
F2	-1.266	0.845	0.000
O3	0.345	-0.637	1.241
O4	0.345	-0.637	-1.241

	Cl1	F2	O3	O4
Cl1		1.7542	1.4700	1.4700
F2	1.7542		2.5164	2.5164
O3	1.4700	2.5164		2.4816
O4	1.4700	2.5164	2.4816

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Cl1	O3	102.246		F2	Cl1	O4	102.246
O3	Cl1	O4	115.146

All results from a given calculation for ClO₂F (Chloryl fluoride)

using model chemistry: SVWN/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	Cl	1.063
2	F	-0.350
3	O	-0.356
4	O	-0.356

	x	y	z	Total
	1.848	0.971	0.000	2.087
CHELPG
AIM
ESP

	x	y	z
x	3.869	-0.946	0.000
y	-0.946	3.696	0.000
z	0.000	0.000	5.184

<r²>	74.637
(<r²>)^1/2	8.639

All results from a given calculation for ClO2F (Chloryl fluoride)

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

States and conformations

All results from a given calculation for ClO₂F (Chloryl fluoride)