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	hartrees
Energy at 0K	-473.580317
Energy at 298.15K	-473.584160
HF Energy	-473.273820
Nuclear repulsion energy	92.287546

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3185	3029	7.97
2	A'	3128	2976	15.98
3	A'	3071	2922	2.73
4	A'	1580	1503	6.33
5	A'	1482	1410	10.51
6	A'	1447	1377	35.83
7	A'	1185	1127	23.04
8	A'	1132	1076	0.75
9	A'	837	797	3.28
10	A'	413	393	1.03
11	A"	3131	2979	7.67
12	A"	1577	1500	10.77
13	A"	1116	1061	2.30
14	A"	799	760	22.15
15	A"	164	156	0.18

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.630	0.000
C2	-1.516	0.690	0.000
S3	0.892	-0.730	0.000
H4	0.497	1.602	0.000
H5	-1.937	-0.318	0.000
H6	-1.866	1.236	0.886
H7	-1.866	1.236	-0.886

	C1	C2	S3	H4	H5	H6	H7
C1		1.5171	1.6259	1.0925	2.1562	2.1529	2.1529
C2	1.5171		2.7952	2.2103	1.0925	1.0977	1.0977
S3	1.6259	2.7952		2.3653	2.8583	3.5006	3.5006
H4	1.0925	2.2103	2.3653		3.1005	2.5507	2.5507
H5	2.1562	1.0925	2.8583	3.1005		1.7898	1.7898
H6	2.1529	1.0977	3.5006	2.5507	1.7898		1.7716
H7	2.1529	1.0977	3.5006	2.5507	1.7898	1.7716

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.373	C1	C2	H6	109.801
C1	C2	H7	109.801	C2	C1	S3	125.549
C2	C1	H4	114.800	S3	C1	H4	119.652
H5	C2	H6	109.610	H5	C2	H7	109.610
H6	C2	H7	107.599

All results from a given calculation for CH₃CHS (Thioacetaldehyde)

using model chemistry: MP2/3-21G*

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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All results from a given calculation for CH3CHS (Thioacetaldehyde)

using model chemistry: MP2/3-21G*

States and conformations

All results from a given calculation for CH₃CHS (Thioacetaldehyde)