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	hartrees
Energy at 0K	-629.055852
Energy at 298.15K	-629.062469
Nuclear repulsion energy	287.734211

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3257	3128	0.81
2	A'	3197	3071	9.00
3	A'	3167	3041	1.38
4	A'	1690	1623	1.82
5	A'	1422	1366	12.20
6	A'	1289	1238	1.16
7	A'	1087	1044	69.16
8	A'	1013	972	18.71
9	A'	999	959	38.96
10	A'	959	921	15.18
11	A'	707	679	69.38
12	A'	624	599	1.45
13	A'	488	469	1.09
14	A'	300	288	1.76
15	A'	198	190	2.57
16	A'	91	87	0.51
17	A"	3257	3128	1.62
18	A"	3193	3066	4.62
19	A"	3166	3040	4.10
20	A"	1680	1613	3.94
21	A"	1419	1362	3.13
22	A"	1270	1220	13.27
23	A"	1005	965	2.82
24	A"	987	948	40.31
25	A"	957	919	4.31
26	A"	629	604	10.51
27	A"	564	541	3.50
28	A"	478	459	7.97
29	A"	241	231	6.04
30	A"	163	157	0.64

Atom	x (Å)	y (Å)	z (Å)
S1	0.594	-0.486	0.000
O2	1.285	0.859	0.000
C3	-0.618	-0.493	1.347
C4	-0.618	-0.493	-1.347
C5	-0.618	0.494	2.235
C6	-0.618	0.494	-2.235
H7	-1.250	-1.378	1.396
H8	-1.250	-1.378	-1.396
H9	-1.294	0.492	3.086
H10	-1.294	0.492	-3.086
H11	0.064	1.333	2.119
H12	0.064	1.333	-2.119

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5116	1.8120	1.8120	2.7251	2.7251	2.4786	2.4786	3.7474	3.7474	2.8426	2.8426
O2	1.5116		2.6951	2.6951	2.9582	2.9582	3.6571	3.6571	4.0381	4.0381	2.4914	2.4914
C3	1.8120	2.6951		2.6938	1.3283	3.7159	1.0879	2.9501	2.1101	4.5909	2.0968	3.9766
C4	1.8120	2.6951	2.6938		3.7159	1.3283	2.9501	1.0879	4.5909	2.1101	3.9766	2.0968
C5	2.7251	2.9582	1.3283	3.7159		4.4709	2.1466	4.1337	1.0863	5.3638	1.0872	4.4867
C6	2.7251	2.9582	3.7159	1.3283	4.4709		4.1337	2.1466	5.3638	1.0863	4.4867	1.0872
H7	2.4786	3.6571	1.0879	2.9501	2.1466	4.1337		2.7913	2.5211	4.8561	3.0978	4.6289
H8	2.4786	3.6571	2.9501	1.0879	4.1337	2.1466	2.7913		4.8561	2.5211	4.6289	3.0978
H9	3.7474	4.0381	2.1101	4.5909	1.0863	5.3638	2.5211	4.8561		6.1712	1.8664	5.4441
H10	3.7474	4.0381	4.5909	2.1101	5.3638	1.0863	4.8561	2.5211	6.1712		5.4441	1.8664
H11	2.8426	2.4914	2.0968	3.9766	1.0872	4.4867	3.0978	4.6289	1.8664	5.4441		4.2383
H12	2.8426	2.4914	3.9766	2.0968	4.4867	1.0872	4.6289	3.0978	5.4441	1.8664	4.2383

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	119.608	S1	C3	H7	115.166
S1	C4	C6	119.608	S1	C4	H8	115.166
O2	S1	C3	108.026	O2	S1	C4	108.026
C3	S1	C4	96.033	C3	C5	H9	121.504
C3	C5	H11	120.143	C4	C6	H10	121.504
C4	C6	H12	120.143	C5	C3	H7	125.046
C6	C4	H8	125.046	H9	C5	H11	118.351
H10	C6	H12	118.351

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

using model chemistry: G3B3

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	0.784
2	O	-0.623
3	C	-0.305
4	C	-0.305
5	C	-0.302
6	C	-0.302
7	H	0.168
8	H	0.168
9	H	0.163
10	H	0.163
11	H	0.196
12	H	0.196

	x	y	z	Total
	-2.845	-1.822	0.000	3.379
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: G3B3

States and conformations

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