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	hartrees
Energy at 0K	-1468.932082
Energy at 298.15K	-1468.934095
Nuclear repulsion energy	398.358087

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1187	1130	170.16
2	A₁	552	526	113.57
3	A₁	390	371	0.48
4	A₁	201	192	0.01
5	A₂	265	253	0.00
6	B₁	581	553	318.83
7	B₁	373	355	1.89
8	B₂	1424	1355	200.30
9	B₂	350	334	7.46

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.506
O2	0.000	1.267	1.189
O3	0.000	-1.267	1.189
Cl4	1.575	0.000	-0.798
Cl5	-1.575	0.000	-0.798

	S1	O2	O3	Cl4	Cl5
S1		1.4392	1.4392	2.0450	2.0450
O2	1.4392		2.5336	2.8345	2.8345
O3	1.4392	2.5336		2.8345	2.8345
Cl4	2.0450	2.8345	2.8345		3.1509
Cl5	2.0450	2.8345	2.8345	3.1509

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	123.339	O2	S1	Cl4	107.613
O2	S1	Cl5	107.613	O3	S1	Cl4	107.613
O3	S1	Cl5	107.613	Cl4	S1	Cl5	100.773

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

using model chemistry: mPW1PW91/6-31+G**

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	0.422
2	O	-0.320
3	O	-0.320
4	Cl	0.109
5	Cl	0.109

	x	y	z	Total
	0.000	0.000	-1.673	1.673
CHELPG
AIM
ESP

<r²>	189.128
(<r²>)^1/2	13.752

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

using model chemistry: mPW1PW91/6-31+G**

States and conformations

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