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	hartrees
Energy at 0K	-710.248074
Energy at 298.15K
HF Energy	-710.248074
Nuclear repulsion energy	185.121258

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	974	974	59.20
2	A'	584	584	108.66
3	A'	478	478	31.16
4	A'	335	335	1.54
5	A"	1124	1124	157.87
6	A"	282	282	5.82

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.349	0.136	0.000
F2	-1.279	0.907	0.000
O3	0.349	-0.655	1.253
O4	0.349	-0.655	-1.253

	Cl1	F2	O3	O4
Cl1		1.8014	1.4818	1.4818
F2	1.8014		2.5807	2.5807
O3	1.4818	2.5807		2.5064
O4	1.4818	2.5807	2.5064

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Cl1	O3	103.199		F2	Cl1	O4	103.199
O3	Cl1	O4	115.504

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

using model chemistry: BLYP/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	0.914
2	F	-0.308
3	O	-0.303
4	O	-0.303

	x	y	z	Total
	1.732	0.780	0.000	1.899
CHELPG
AIM
ESP

	x	y	z
x	2.920	-1.004	0.000
y	-1.004	2.743	0.000
z	0.000	0.000	4.125

<r²>	76.079
(<r²>)^1/2	8.722

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

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

States and conformations

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