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	hartrees
Energy at 0K	-708.346563
Energy at 298.15K
HF Energy	-708.346563
Nuclear repulsion energy	199.413560

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1240	1240	136.60
2	A'	762	762	269.31
3	A'	650	650	68.85
4	A'	488	488	1.39
5	A"	1414	1414	344.20
6	A"	433	433	19.35

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.322	0.151	0.000
F2	-1.179	0.787	0.000
O3	0.322	-0.603	1.176
O4	0.322	-0.603	-1.176

	Cl1	F2	O3	O4
Cl1		1.6295	1.3971	1.3971
F2	1.6295		2.3591	2.3591
O3	1.3971	2.3591		2.3521
O4	1.3971	2.3591	2.3521

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Cl1	O3	102.151		F2	Cl1	O4	102.151
O3	Cl1	O4	114.661

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

using model chemistry: HF/cc-pV(D+d)Z

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	1.329
2	F	-0.383
3	O	-0.473
4	O	-0.473

	x	y	z	Total
	1.527	1.617	0.000	2.224
CHELPG
AIM
ESP

	x	y	z
x	2.420	-0.710	0.000
y	-0.710	2.268	0.000
z	0.000	0.000	3.244

<r²>	67.795
(<r²>)^1/2	8.234

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

using model chemistry: HF/cc-pV(D+d)Z

States and conformations

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