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	hartrees
Energy at 0K	-629.391713
Energy at 298.15K	-629.397809
HF Energy	-629.391713
Nuclear repulsion energy	290.119279

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3243	3130	0.81
2	A'	3187	3075	8.28
3	A'	3146	3036	1.75
4	A'	1661	1603	2.07
5	A'	1406	1357	12.81
6	A'	1269	1225	0.74
7	A'	1115	1076	74.29
8	A'	1006	971	35.48
9	A'	990	956	3.05
10	A'	958	925	16.42
11	A'	703	678	55.66
12	A'	620	598	1.30
13	A'	485	468	0.79
14	A'	294	283	0.98
15	A'	193	186	1.93
16	A'	92	89	0.39
17	A"	3243	3129	1.26
18	A"	3183	3071	4.08
19	A"	3145	3035	6.26
20	A"	1651	1593	4.58
21	A"	1401	1352	3.05
22	A"	1251	1207	12.50
23	A"	1002	967	15.93
24	A"	970	936	23.94
25	A"	955	922	3.57
26	A"	626	604	6.87
27	A"	559	539	3.20
28	A"	471	454	8.42
29	A"	241	233	3.97
30	A"	170	164	0.93

Atom	x (Å)	y (Å)	z (Å)
S1	0.594	-0.504	0.000
O2	1.278	0.831	0.000
C3	-0.617	-0.492	1.332
C4	-0.617	-0.492	-1.332
C5	-0.617	0.522	2.190
C6	-0.617	0.522	-2.190
H7	-1.241	-1.378	1.402
H8	-1.241	-1.378	-1.402
H9	-1.288	0.547	3.041
H10	-1.288	0.547	-3.041
H11	0.064	1.355	2.042
H12	0.064	1.355	-2.042

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.4992	1.8005	1.8005	2.7040	2.7040	2.4698	2.4698	3.7279	3.7279	2.8117	2.8117
O2	1.4992		2.6672	2.6672	2.9119	2.9119	3.6318	3.6318	3.9895	3.9895	2.4329	2.4329
C3	1.8005	2.6672		2.6650	1.3272	3.6649	1.0863	2.9418	2.1095	4.5453	2.0923	3.9065
C4	1.8005	2.6672	2.6650		3.6649	1.3272	2.9418	1.0863	4.5453	2.1095	3.9065	2.0923
C5	2.7040	2.9119	1.3272	3.6649		4.3790	2.1489	4.1109	1.0851	5.2738	1.0862	4.3660
C6	2.7040	2.9119	3.6649	1.3272	4.3790		4.1109	2.1489	5.2738	1.0851	4.3660	1.0862
H7	2.4698	3.6318	1.0863	2.9418	2.1489	4.1109		2.8047	2.5283	4.8427	3.0954	4.5864
H8	2.4698	3.6318	2.9418	1.0863	4.1109	2.1489	2.8047		4.8427	2.5283	4.5864	3.0954
H9	3.7279	3.9895	2.1095	4.5453	1.0851	5.2738	2.5283	4.8427		6.0824	1.8657	5.3216
H10	3.7279	3.9895	4.5453	2.1095	5.2738	1.0851	4.8427	2.5283	6.0824		5.3216	1.8657
H11	2.8117	2.4329	2.0923	3.9065	1.0862	4.3660	3.0954	4.5864	1.8657	5.3216		4.0837
H12	2.8117	2.4329	3.9065	2.0923	4.3660	1.0862	4.5864	3.0954	5.3216	1.8657	4.0837

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	118.876	S1	C3	H7	115.400
S1	C4	C6	118.876	S1	C4	H8	115.400
O2	S1	C3	107.512	O2	S1	C4	107.512
C3	S1	C4	95.474	C3	C5	H9	121.639
C3	C5	H11	119.882	C4	C6	H10	121.639
C4	C6	H12	119.882	C5	C3	H7	125.538
C6	C4	H8	125.538	H9	C5	H11	118.477
H10	C6	H12	118.477

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

using model chemistry: TPSSh/6-31G(2df,p)

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

using model chemistry: TPSSh/6-31G(2df,p)

States and conformations

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