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	hartrees
Energy at 0K	-629.375074
Energy at 298.15K	-629.381122
HF Energy	-629.375074
Nuclear repulsion energy	287.803181

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3256	3133	0.52
2	A'	3198	3079	7.31
3	A'	3156	3038	1.84
4	A'	1665	1603	3.01
5	A'	1415	1362	15.17
6	A'	1281	1232	1.33
7	A'	1069	1029	85.86
8	A'	1004	966	27.53
9	A'	995	957	54.32
10	A'	959	923	9.53
11	A'	699	673	73.68
12	A'	618	595	2.20
13	A'	480	462	0.26
14	A'	291	280	1.52
15	A'	187	180	2.67
16	A'	94	91	0.74
17	A"	3255	3133	1.19
18	A"	3194	3074	2.78
19	A"	3156	3037	6.01
20	A"	1655	1593	11.08
21	A"	1410	1358	1.44
22	A"	1262	1214	13.17
23	A"	997	960	8.38
24	A"	982	945	49.12
25	A"	955	919	0.21
26	A"	623	599	6.79
27	A"	560	539	6.65
28	A"	470	452	8.15
29	A"	231	223	5.90
30	A"	164	158	0.73

Atom	x (Å)	y (Å)	z (Å)
S1	0.586	-0.483	0.000
O2	1.291	0.848	0.000
C3	-0.615	-0.488	1.339
C4	-0.615	-0.488	-1.339
C5	-0.615	0.494	2.242
C6	-0.615	0.494	-2.242
H7	-1.250	-1.371	1.389
H8	-1.250	-1.371	-1.389
H9	-1.291	0.473	3.092
H10	-1.291	0.473	-3.092
H11	0.065	1.336	2.145
H12	0.065	1.336	-2.145

	S1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12
S1		1.5056	1.7992	1.7992	2.7248	2.7248	2.4684	2.4684	3.7413	3.7413	2.8602	2.8602
O2	1.5056		2.6857	2.6857	2.9645	2.9645	3.6486	3.6486	4.0458	4.0458	2.5186	2.5186
C3	1.7992	2.6857		2.6784	1.3340	3.7137	1.0884	2.9373	2.1101	4.5843	2.1073	3.9913
C4	1.7992	2.6857	2.6784		3.7137	1.3340	2.9373	1.0884	4.5843	2.1101	3.9913	2.1073
C5	2.7248	2.9645	1.3340	3.7137		4.4847	2.1462	4.1314	1.0858	5.3771	1.0873	4.5189
C6	2.7248	2.9645	3.7137	1.3340	4.4847		4.1314	2.1462	5.3771	1.0858	4.5189	1.0873
H7	2.4684	3.6486	1.0884	2.9373	2.1462	4.1314		2.7789	2.5096	4.8460	3.1029	4.6421
H8	2.4684	3.6486	2.9373	1.0884	4.1314	2.1462	2.7789		4.8460	2.5096	4.6421	3.1029
H9	3.7413	4.0458	2.1101	4.5843	1.0858	5.3771	2.5096	4.8460		6.1841	1.8657	5.4781
H10	3.7413	4.0458	4.5843	2.1101	5.3771	1.0858	4.8460	2.5096	6.1841		5.4781	1.8657
H11	2.8602	2.5186	2.1073	3.9913	1.0873	4.5189	3.1029	4.6421	1.8657	5.4781		4.2898
H12	2.8602	2.5186	3.9913	2.1073	4.5189	1.0873	4.6421	3.1029	5.4781	1.8657	4.2898

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
S1	C3	C5	120.106	S1	C3	H7	115.258
S1	C4	C6	120.106	S1	C4	H8	115.258
O2	S1	C3	108.388	O2	S1	C4	108.388
C3	S1	C4	96.201	C3	C5	H9	121.041
C3	C5	H11	120.645	C4	C6	H10	121.041
C4	C6	H12	120.645	C5	C3	H7	124.428
C6	C4	H8	124.428	H9	C5	H11	118.314
H10	C6	H12	118.314

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

using model chemistry: TPSSh/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	0.661
2	O	-0.690
3	C	-0.240
4	C	-0.240
5	C	-0.291
6	C	-0.291
7	H	0.179
8	H	0.179
9	H	0.166
10	H	0.166
11	H	0.200
12	H	0.200

	x	y	z	Total
	-3.032	-1.923	0.000	3.591
CHELPG
AIM
ESP

	x	y	z
x	8.798	0.722	0.000
y	0.722	9.793	0.000
z	0.000	0.000	14.006

<r²>	197.256
(<r²>)^1/2	14.045

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

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

States and conformations

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