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	hartrees
Energy at 0K	-1468.247235
Energy at 298.15K	-1468.248987
Nuclear repulsion energy	390.077212

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1108	1095	136.12
2	A₁	505	499	95.07
3	A₁	347	343	2.58
4	A₁	182	180	0.02
5	A₂	245	242	0.00
6	B₁	524	518	276.45
7	B₁	333	329	6.63
8	B₂	1336	1321	157.76
9	B₂	322	319	5.57

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.522
O2	0.000	1.291	1.212
O3	0.000	-1.291	1.212
Cl4	1.611	0.000	-0.816
Cl5	-1.611	0.000	-0.816

	S1	O2	O3	Cl4	Cl5
S1		1.4635	1.4635	2.0943	2.0943
O2	1.4635		2.5814	2.8937	2.8937
O3	1.4635	2.5814		2.8937	2.8937
Cl4	2.0943	2.8937	2.8937		3.2227
Cl5	2.0943	2.8937	2.8937	3.2227

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	O3	123.747	O2	S1	Cl4	107.525
O2	S1	Cl5	107.525	O3	S1	Cl4	107.525
O3	S1	Cl5	107.525	Cl4	S1	Cl5	100.602

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

using model chemistry: PBEPBE/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	0.323
2	O	-0.262
3	O	-0.262
4	Cl	0.101
5	Cl	0.101

	x	y	z	Total
	0.000	0.000	-1.255	1.255
CHELPG
AIM
ESP

<r²>	196.287
(<r²>)^1/2	14.010

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

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

States and conformations

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