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	hartrees
Energy at 0K	-629.200093
Energy at 298.15K	-629.206201
Nuclear repulsion energy	288.885466

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3270	3129	0.45
2	A'	3210	3071	6.92
3	A'	3175	3037	1.45
4	A'	1696	1622	1.98
5	A'	1417	1356	13.53
6	A'	1286	1230	0.77
7	A'	1111	1063	77.00
8	A'	1012	968	15.29
9	A'	998	954	43.75
10	A'	959	917	18.92
11	A'	711	681	72.30
12	A'	637	609	3.16
13	A'	491	470	0.72
14	A'	302	288	1.51
15	A'	196	187	2.69
16	A'	91	88	0.54
17	A"	3270	3128	1.15
18	A"	3205	3067	3.43
19	A"	3174	3037	4.42
20	A"	1685	1612	4.45
21	A"	1413	1352	4.03
22	A"	1266	1212	10.50
23	A"	1002	959	3.86
24	A"	984	942	44.17
25	A"	956	914	5.95
26	A"	647	619	9.81
27	A"	565	540	4.21
28	A"	481	460	8.38
29	A"	237	227	6.02
30	A"	166	159	0.71

Atom	x (Å)	y (Å)	z (Å)
S1	0.592	-0.482	0.000
O2	1.278	0.858	0.000
C3	-0.614	-0.495	1.337
C4	-0.614	-0.495	-1.337
C5	-0.614	0.492	2.226
C6	-0.614	0.492	-2.226
H7	-1.247	-1.379	1.386
H8	-1.247	-1.379	-1.386
H9	-1.292	0.489	3.075
H10	-1.292	0.489	-3.075
H11	0.068	1.331	2.108
H12	0.068	1.331	-2.108

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5059	1.8005	1.8005	2.7124	2.7124	2.4709	2.4709	3.7346	3.7346	2.8298	2.8298
O2	1.5059		2.6828	2.6828	2.9442	2.9442	3.6469	3.6469	4.0243	4.0243	2.4765	2.4765
C3	1.8005	2.6828		2.6735	1.3278	3.6964	1.0883	2.9318	2.1090	4.5707	2.0959	3.9581
C4	1.8005	2.6828	2.6735		3.6964	1.3278	2.9318	1.0883	4.5707	2.1090	3.9581	2.0959
C5	2.7124	2.9442	1.3278	3.6964		4.4512	2.1457	4.1162	1.0864	5.3439	1.0877	4.4669
C6	2.7124	2.9442	3.6964	1.3278	4.4512		4.1162	2.1457	5.3439	1.0864	4.4669	1.0877
H7	2.4709	3.6469	1.0883	2.9318	2.1457	4.1162		2.7720	2.5187	4.8366	3.0971	4.6132
H8	2.4709	3.6469	2.9318	1.0883	4.1162	2.1457	2.7720		4.8366	2.5187	4.6132	3.0971
H9	3.7346	4.0243	2.1090	4.5707	1.0864	5.3439	2.5187	4.8366		6.1505	1.8684	5.4247
H10	3.7346	4.0243	4.5707	2.1090	5.3439	1.0864	4.8366	2.5187	6.1505		5.4247	1.8684
H11	2.8298	2.4765	2.0959	3.9581	1.0877	4.4669	3.0971	4.6132	1.8684	5.4247		4.2169
H12	2.8298	2.4765	3.9581	2.0959	4.4669	1.0877	4.6132	3.0971	5.4247	1.8684	4.2169

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	119.469	S1	C3	H7	115.372
S1	C4	C6	119.469	S1	C4	H8	115.372
O2	S1	C3	108.134	O2	S1	C4	108.134
C3	S1	C4	95.874	C3	C5	H9	121.440
C3	C5	H11	120.062	C4	C6	H10	121.440
C4	C6	H12	120.062	C5	C3	H7	124.978
C6	C4	H8	124.978	H9	C5	H11	118.497
H10	C6	H12	118.497

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

using model chemistry: B3PW91/6-31G*

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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Number	Element	Mulliken
1	S	0.805
2	O	-0.625
3	C	-0.349
4	C	-0.349
5	C	-0.348
6	C	-0.348
7	H	0.198
8	H	0.198
9	H	0.188
10	H	0.188
11	H	0.220
12	H	0.220

	x	y	z	Total
	-2.860	-1.797	0.000	3.377
CHELPG
AIM
ESP

	x	y	z
x	6.979	1.114	0.000
y	1.114	8.128	0.000
z	0.000	0.000	12.257

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B3PW91/6-31G*

States and conformations

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