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	hartrees
Energy at 0K	-629.353426
Energy at 298.15K	-629.359742
Nuclear repulsion energy	291.313447

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3252	3122	0.33
2	A'	3198	3071	5.34
3	A'	3148	3023	2.74
4	A'	1682	1615	2.09
5	A'	1407	1351	18.02
6	A'	1270	1219	1.12
7	A'	1098	1054	89.37
8	A'	1007	966	26.31
9	A'	997	957	33.88
10	A'	967	928	8.06
11	A'	707	678	78.38
12	A'	635	610	2.36
13	A'	505	485	0.92
14	A'	311	298	3.13
15	A'	227	218	1.89
16	A'	101	97	0.77
17	A"	3252	3122	0.61
18	A"	3194	3067	2.39
19	A"	3148	3022	4.94
20	A"	1673	1606	6.10
21	A"	1403	1347	5.09
22	A"	1252	1202	8.86
23	A"	999	959	14.16
24	A"	981	942	45.57
25	A"	963	924	0.90
26	A"	634	609	8.79
27	A"	569	546	7.27
28	A"	486	466	9.63
29	A"	288	277	7.18
30	A"	171	164	0.92

Atom	x (Å)	y (Å)	z (Å)
S1	0.591	-0.536	0.000
O2	1.297	0.786	0.000
C3	-0.620	-0.483	1.330
C4	-0.620	-0.483	-1.330
C5	-0.620	0.565	2.133
C6	-0.620	0.565	-2.133
H7	-1.248	-1.361	1.428
H8	-1.248	-1.361	-1.428
H9	-1.297	0.634	2.975
H10	-1.297	0.634	-2.975
H11	0.071	1.379	1.942
H12	0.071	1.379	-1.942

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.4991	1.7998	1.7998	2.6887	2.6887	2.4702	2.4702	3.7125	3.7125	2.7765	2.7765
O2	1.4991		2.6561	2.6561	2.8761	2.8761	3.6231	3.6231	3.9494	3.9494	2.3712	2.3712
C3	1.7998	2.6561		2.6601	1.3204	3.6180	1.0839	2.9618	2.1003	4.4984	2.0786	3.8275
C4	1.7998	2.6561	2.6601		3.6180	1.3204	2.9618	1.0839	4.4984	2.1003	3.8275	2.0786
C5	2.6887	2.8761	1.3204	3.6180		4.2654	2.1453	4.0970	1.0823	5.1523	1.0850	4.2119
C6	2.6887	2.8761	3.6180	1.3204	4.2654		4.0970	2.1453	5.1523	1.0823	4.2119	1.0850
H7	2.4702	3.6231	1.0839	2.9618	2.1453	4.0970		2.8562	2.5252	4.8341	3.0846	4.5393
H8	2.4702	3.6231	2.9618	1.0839	4.0970	2.1453	2.8562		4.8341	2.5252	4.5393	3.0846
H9	3.7125	3.9494	2.1003	4.4984	1.0823	5.1523	2.5252	4.8341		5.9490	1.8692	5.1570
H10	3.7125	3.9494	4.4984	2.1003	5.1523	1.0823	4.8341	2.5252	5.9490		5.1570	1.8692
H11	2.7765	2.3712	2.0786	3.8275	1.0850	4.2119	3.0846	4.5393	1.8692	5.1570		3.8831
H12	2.7765	2.3712	3.8275	2.0786	4.2119	1.0850	4.5393	3.0846	5.1570	1.8692	3.8831

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	118.208	S1	C3	H7	115.639
S1	C4	C6	118.208	S1	C4	H8	115.639
O2	S1	C3	106.901	O2	S1	C4	106.901
C3	S1	C4	95.293	C3	C5	H9	121.564
C3	C5	H11	119.246	C4	C6	H10	121.564
C4	C6	H12	119.246	C5	C3	H7	126.039
C6	C4	H8	126.039	H9	C5	H11	119.189
H10	C6	H12	119.189

All results from a given calculation for C₄H₆OS (Vinyl sulfoxide)

using model chemistry: B1B95/6-311G**

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	0.687
2	O	-0.569
3	C	-0.332
4	C	-0.332
5	C	-0.189
6	C	-0.189
7	H	0.158
8	H	0.158
9	H	0.139
10	H	0.139
11	H	0.166
12	H	0.166

	x	y	z	Total
	-3.089	-1.769	0.000	3.560
CHELPG
AIM
ESP

	x	y	z
x	7.644	0.649	0.000
y	0.649	9.027	0.000
z	0.000	0.000	12.234

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C4H6OS (Vinyl sulfoxide)

using model chemistry: B1B95/6-311G**

States and conformations

All results from a given calculation for C₄H₆OS (Vinyl sulfoxide)