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	hartrees
Energy at 0K	-1468.828799
Energy at 298.15K	-1468.830676
Nuclear repulsion energy	392.825878

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1127	1087	135.01
2	A₁	528	509	90.25
3	A₁	369	356	0.30
4	A₁	192	185	0.09
5	A₂	248	239	0.00
6	B₁	549	530	265.46
7	B₁	349	337	2.11
8	B₂	1346	1298	148.47
9	B₂	329	318	3.40

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.521
O2	0.000	1.287	1.213
O3	0.000	-1.287	1.213
Cl4	1.586	0.000	-0.816
Cl5	-1.586	0.000	-0.816

	S1	O2	O3	Cl4	Cl5
S1		1.4615	1.4615	2.0744	2.0744
O2	1.4615		2.5746	2.8792	2.8792
O3	1.4615	2.5746		2.8792	2.8792
Cl4	2.0744	2.8792	2.8792		3.1715
Cl5	2.0744	2.8792	2.8792	3.1715

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	123.485	O2	S1	Cl4	107.772
O2	S1	Cl5	107.772	O3	S1	Cl4	107.772
O3	S1	Cl5	107.772	Cl4	S1	Cl5	99.714

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

using model chemistry: B3PW91/aug-cc-pVDZ

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	1.262
2	O	-0.585
3	O	-0.585
4	Cl	-0.047
5	Cl	-0.047

	x	y	z	Total
	0.000	0.000	-1.611	1.611
CHELPG
AIM
ESP

<r²>	192.927
(<r²>)^1/2	13.890

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

using model chemistry: B3PW91/aug-cc-pVDZ

States and conformations

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