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	hartrees
Energy at 0K	-1460.930703
Energy at 298.15K	-1460.931566
Nuclear repulsion energy	348.033865

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	926	918	31.98
2	A₁	417	414	49.15
3	A₁	256	253	1.45
4	A₁	107	106	0.45
5	A₂	153	152	0.00
6	B₁	391	387	126.59
7	B₁	228	226	0.28
8	B₂	1103	1093	24.80
9	B₂	206	204	6.99

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.630
O2	0.000	1.387	1.398
O3	0.000	-1.387	1.398
Cl4	1.802	0.000	-0.955
Cl5	-1.802	0.000	-0.955

	S1	O2	O3	Cl4	Cl5
S1		1.5853	1.5853	2.3997	2.3997
O2	1.5853		2.7732	3.2722	3.2722
O3	1.5853	2.7732		3.2722	3.2722
Cl4	2.3997	3.2722	3.2722		3.6044
Cl5	2.3997	3.2722	3.2722	3.6044

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	122.003	O2	S1	Cl4	108.668
O2	S1	Cl5	108.668	O3	S1	Cl4	108.668
O3	S1	Cl5	108.668	Cl4	S1	Cl5	97.360

All results from a given calculation for SO₂Cl₂ (Sulfuryl chloride)

using model chemistry: PBEPBE/3-21G

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	S	1.017
2	O	-0.363
3	O	-0.363
4	Cl	-0.146
5	Cl	-0.146

	x	y	z	Total
	0.000	0.000	0.926	0.926
CHELPG
AIM
ESP

<r²>	241.760
(<r²>)^1/2	15.549

All results from a given calculation for SO2Cl2 (Sulfuryl chloride)

using model chemistry: PBEPBE/3-21G

States and conformations

All results from a given calculation for SO₂Cl₂ (Sulfuryl chloride)