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	hartrees
Energy at 0K	-629.303884
Energy at 298.15K	-629.310060
Nuclear repulsion energy	289.355631

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3285	3127	0.28
2	A'	3224	3069	4.15
3	A'	3182	3028	2.07
4	A'	1694	1612	2.47
5	A'	1410	1342	16.53
6	A'	1284	1222	0.79
7	A'	1101	1048	96.15
8	A'	1013	964	16.05
9	A'	1000	952	68.10
10	A'	974	928	5.88
11	A'	714	680	75.06
12	A'	643	612	4.90
13	A'	493	469	0.23
14	A'	302	287	1.75
15	A'	197	187	2.97
16	A'	95	91	0.78
17	A"	3285	3126	0.33
18	A"	3220	3065	1.95
19	A"	3181	3028	3.51
20	A"	1683	1602	9.04
21	A"	1406	1339	4.22
22	A"	1265	1204	9.11
23	A"	1002	954	5.08
24	A"	989	941	56.13
25	A"	970	923	0.43
26	A"	655	623	7.96
27	A"	571	544	6.57
28	A"	484	460	9.81
29	A"	242	231	6.66
30	A"	165	157	0.71

Atom	x (Å)	y (Å)	z (Å)
S1	0.590	-0.489	0.000
O2	1.271	0.854	0.000
C3	-0.611	-0.492	1.336
C4	-0.611	-0.492	-1.336
C5	-0.611	0.499	2.219
C6	-0.611	0.499	-2.219
H7	-1.245	-1.373	1.389
H8	-1.245	-1.373	-1.389
H9	-1.293	0.495	3.063
H10	-1.293	0.495	-3.063
H11	0.073	1.334	2.101
H12	0.073	1.334	-2.101

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5058	1.7966	1.7966	2.7102	2.7102	2.4649	2.4649	3.7276	3.7276	2.8292	2.8292
O2	1.5058		2.6718	2.6718	2.9317	2.9317	3.6353	3.6353	4.0101	4.0101	2.4655	2.4655
C3	1.7966	2.6718		2.6719	1.3273	3.6908	1.0864	2.9328	2.1026	4.5594	2.0944	3.9512
C4	1.7966	2.6718	2.6719		3.6908	1.3273	2.9328	1.0864	4.5594	2.1026	3.9512	2.0944
C5	2.7102	2.9317	1.3273	3.6908		4.4389	2.1434	4.1137	1.0842	5.3261	1.0862	4.4531
C6	2.7102	2.9317	3.6908	1.3273	4.4389		4.1137	2.1434	5.3261	1.0842	4.4531	1.0862
H7	2.4649	3.6353	1.0864	2.9328	2.1434	4.1137		2.7774	2.5091	4.8279	3.0935	4.6086
H8	2.4649	3.6353	2.9328	1.0864	4.1137	2.1434	2.7774		4.8279	2.5091	4.6086	3.0935
H9	3.7276	4.0101	2.1026	4.5594	1.0842	5.3261	2.5091	4.8279		6.1257	1.8691	5.4065
H10	3.7276	4.0101	4.5594	2.1026	5.3261	1.0842	4.8279	2.5091	6.1257		5.4065	1.8691
H11	2.8292	2.4655	2.0944	3.9512	1.0862	4.4531	3.0935	4.6086	1.8691	5.4065		4.2015
H12	2.8292	2.4655	3.9512	2.0944	4.4531	1.0862	4.6086	3.0935	5.4065	1.8691	4.2015

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	119.595	S1	C3	H7	115.285
S1	C4	C6	119.595	S1	C4	H8	115.285
O2	S1	C3	107.675	O2	S1	C4	107.675
C3	S1	C4	96.074	C3	C5	H9	121.036
C3	C5	H11	120.073	C4	C6	H10	121.036
C4	C6	H12	120.073	C5	C3	H7	124.953
C6	C4	H8	124.953	H9	C5	H11	118.890
H10	C6	H12	118.890

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

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	0.698
2	O	-0.722
3	C	-0.266
4	C	-0.266
5	C	-0.297
6	C	-0.297
7	H	0.190
8	H	0.190
9	H	0.175
10	H	0.175
11	H	0.211
12	H	0.211

	x	y	z	Total
	-3.102	-1.950	0.000	3.664
CHELPG
AIM
ESP

	x	y	z
x	8.564	0.667	0.000
y	0.667	9.622	0.000
z	0.000	0.000	13.617

<r²>	0.000
(<r²>)^1/2	0.000

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

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

States and conformations

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