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	hartrees
Energy at 0K	-1468.941999
Energy at 298.15K	-1468.943865
Nuclear repulsion energy	393.018470

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1155	1107	142.84
2	A₁	535	513	106.24
3	A₁	365	350	2.64
4	A₁	192	184	0.01
5	A₂	254	243	0.00
6	B₁	555	532	300.74
7	B₁	345	331	4.48
8	B₂	1397	1338	162.97
9	B₂	338	324	8.28

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.520
O2	0.000	1.276	1.204
O3	0.000	-1.276	1.204
Cl4	1.602	0.000	-0.811
Cl5	-1.602	0.000	-0.811

	S1	O2	O3	Cl4	Cl5
S1		1.4476	1.4476	2.0825	2.0825
O2	1.4476		2.5516	2.8728	2.8728
O3	1.4476	2.5516		2.8728	2.8728
Cl4	2.0825	2.8728	2.8728		3.2044
Cl5	2.0825	2.8728	2.8728	3.2044

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	123.599	O2	S1	Cl4	107.571
O2	S1	Cl5	107.571	O3	S1	Cl4	107.571
O3	S1	Cl5	107.571	Cl4	S1	Cl5	100.591

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

using model chemistry: B3LYPultrafine/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	S	0.918
2	O	-0.398
3	O	-0.398
4	Cl	-0.061
5	Cl	-0.061

	x	y	z	Total
	0.000	0.000	-1.246	1.246
CHELPG
AIM
ESP

<r²>	193.770
(<r²>)^1/2	13.920

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

using model chemistry: B3LYPultrafine/6-31G*

States and conformations

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