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	hartrees
Energy at 0K	-626.072605
Energy at 298.15K	-626.078754
Nuclear repulsion energy	282.516048

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3260	3146	0.31
2	A'	3231	3117	0.99
3	A'	3098	2989	9.49
4	A'	1682	1623	6.63
5	A'	1435	1384	36.92
6	A'	1277	1232	13.48
7	A'	1063	1025	62.91
8	A'	1007	972	0.71
9	A'	986	951	1.56
10	A'	837	807	17.16
11	A'	703	678	82.68
12	A'	555	536	0.17
13	A'	488	471	2.09
14	A'	309	298	4.61
15	A'	227	219	2.56
16	A'	109	105	0.54
17	A"	3258	3144	2.79
18	A"	3230	3117	0.78
19	A"	3095	2986	14.10
20	A"	1673	1614	17.17
21	A"	1428	1378	10.33
22	A"	1256	1212	39.34
23	A"	1054	1017	50.50
24	A"	999	963	9.52
25	A"	980	945	6.81
26	A"	610	588	25.42
27	A"	525	507	3.12
28	A"	453	437	0.36
29	A"	280	270	13.38
30	A"	172	166	1.31

Atom	x (Å)	y (Å)	z (Å)
S1	0.633	-0.630	0.000
O2	1.309	0.881	0.000
C3	-0.650	-0.523	1.411
C4	-0.650	-0.523	-1.411
C5	-0.650	0.635	2.039
C6	-0.650	0.635	-2.039
H7	-1.236	-1.414	1.589
H8	-1.236	-1.414	-1.589
H9	-1.303	0.857	2.875
H10	-1.303	0.857	-2.875
H11	0.047	1.396	1.680
H12	0.047	1.396	-1.680

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.6549	1.9102	1.9102	2.7210	2.7210	2.5750	2.5750	3.7712	3.7712	2.6964	2.6964
O2	1.6549		2.7929	2.7929	2.8382	2.8382	3.7769	3.7769	3.8843	3.8843	2.1632	2.1632
C3	1.9102	2.7929		2.8222	1.3177	3.6393	1.0808	3.1835	2.1148	4.5496	2.0600	3.7050
C4	1.9102	2.7929	2.8222		3.6393	1.3177	3.1835	1.0808	4.5496	2.1148	3.7050	2.0600
C5	2.7210	2.8382	1.3177	3.6393		4.0778	2.1785	4.2073	1.0835	4.9618	1.0930	3.8597
C6	2.7210	2.8382	3.6393	1.3177	4.0778		4.2073	2.1785	4.9618	1.0835	3.8597	1.0930
H7	2.5750	3.7769	1.0808	3.1835	2.1785	4.2073		3.1772	2.6105	5.0082	3.0909	4.4978
H8	2.5750	3.7769	3.1835	1.0808	4.2073	2.1785	3.1772		5.0082	2.6105	4.4978	3.0909
H9	3.7712	3.8843	2.1148	4.5496	1.0835	4.9618	2.6105	5.0082		5.7495	1.8822	4.7815
H10	3.7712	3.8843	4.5496	2.1148	4.9618	1.0835	5.0082	2.6105	5.7495		4.7815	1.8822
H11	2.6964	2.1632	2.0600	3.7050	1.0930	3.8597	3.0909	4.4978	1.8822	4.7815		3.3603
H12	2.6964	2.1632	3.7050	2.0600	3.8597	1.0930	4.4978	3.0909	4.7815	1.8822	3.3603

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	113.642	S1	C3	H7	116.061
S1	C4	C6	113.642	S1	C4	H8	116.061
O2	S1	C3	102.912	O2	S1	C4	102.912
C3	S1	C4	95.247	C3	C5	H9	123.168
C3	C5	H11	117.113	C4	C6	H10	123.168
C4	C6	H12	117.113	C5	C3	H7	130.272
C6	C4	H8	130.272	H9	C5	H11	119.719
H10	C6	H12	119.719

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

using model chemistry: B3LYP/3-21G

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	0.910
2	O	-0.574
3	C	-0.502
4	C	-0.502
5	C	-0.340
6	C	-0.340
7	H	0.223
8	H	0.223
9	H	0.210
10	H	0.210
11	H	0.241
12	H	0.241

	x	y	z	Total
	-2.857	-1.814	0.000	3.385
CHELPG
AIM
ESP

	x	y	z
x	6.515	0.922	0.000
y	0.922	8.488	0.000
z	0.000	0.000	10.596

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B3LYP/3-21G

States and conformations

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