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	hartrees
Energy at 0K	-627.154207
Energy at 298.15K	-627.162283
HF Energy	-626.388510
Nuclear repulsion energy	272.297538

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3244	3059	0.07
2	A₁	3132	2953	0.83
3	A₁	1520	1434	3.39
4	A₁	1427	1346	18.45
5	A₁	1180	1113	166.96
6	A₁	1057	997	0.00
7	A₁	716	675	11.50
8	A₁	490	462	26.39
9	A₁	277	262	2.44
10	A₂	3249	3064	0.00
11	A₂	1508	1422	0.00
12	A₂	988	931	0.00
13	A₂	292	276	0.00
14	A₂	198	187	0.00
15	B₁	3253	3067	1.00
16	B₁	1525	1438	13.48
17	B₁	1374	1296	228.40
18	B₁	1046	986	0.99
19	B₁	368	347	1.16
20	B₁	230	217	0.51
21	B₂	3243	3058	1.13
22	B₂	3130	2951	0.47
23	B₂	1511	1425	8.29
24	B₂	1410	1330	20.62
25	B₂	1000	943	66.93
26	B₂	791	746	48.74
27	B₂	456	430	38.22

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.059
O2	-1.354	0.000	0.969
O3	1.354	0.000	0.969
C4	0.000	1.286	-0.847
C5	0.000	-1.286	-0.847
H6	0.000	2.130	-0.240
H7	0.000	-2.130	-0.240
H8	0.853	1.292	-1.453
H9	-0.853	1.292	-1.453
H10	-0.853	-1.292	-1.453
H11	0.853	-1.292	-1.453

	S1	O2	O3	C4	C5	H6	H7	H8	H9	H10	H11
S1		1.6310	1.6310	1.5728	1.5728	2.1510	2.1510	2.1646	2.1646	2.1646	2.1646
O2	1.6310		2.7078	2.6043	2.6043	2.7987	2.7987	3.5225	2.7904	2.7904	3.5225
O3	1.6310	2.7078		2.6043	2.6043	2.7987	2.7987	2.7904	3.5225	3.5225	2.7904
C4	1.5728	2.6043	2.6043		2.5712	1.0395	3.4690	1.0469	1.0469	2.7823	2.7823
C5	1.5728	2.6043	2.6043	2.5712		3.4690	1.0395	2.7823	2.7823	1.0469	1.0469
H6	2.1510	2.7987	2.7987	1.0395	3.4690		4.2600	1.7030	1.7030	3.7297	3.7297
H7	2.1510	2.7987	2.7987	3.4690	1.0395	4.2600		3.7297	3.7297	1.7030	1.7030
H8	2.1646	3.5225	2.7904	1.0469	2.7823	1.7030	3.7297		1.7068	3.0973	2.5846
H9	2.1646	2.7904	3.5225	1.0469	2.7823	1.7030	3.7297	1.7068		2.5846	3.0973
H10	2.1646	2.7904	3.5225	2.7823	1.0469	3.7297	1.7030	3.0973	2.5846		1.7068
H11	2.1646	3.5225	2.7904	2.7823	1.0469	3.7297	1.7030	2.5846	3.0973	1.7068

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C4	H6	109.146	S1	C4	H8	109.810
S1	C4	H9	109.810	S1	C5	H7	109.146
S1	C5	H10	109.810	S1	C5	H11	109.810
O2	S1	O3	112.217	O2	S1	C4	108.738
O2	S1	C5	108.738	O3	S1	C4	108.738
O3	S1	C5	108.738	C4	S1	C5	109.646
H6	C4	H8	109.423	H6	C4	H9	109.423
H7	C5	H10	109.423	H7	C5	H11	109.423
H8	C4	H9	109.216	H10	C5	H11	109.216

All results from a given calculation for C₂H₆O₂S (Dimethyl sulfone)

using model chemistry: MP2/6-31G*

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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All results from a given calculation for C2H6O2S (Dimethyl sulfone)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for C₂H₆O₂S (Dimethyl sulfone)