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	hartrees
Energy at 0K	-531.449916
Energy at 298.15K
HF Energy	-530.698523
Nuclear repulsion energy	155.423115

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3767	3767	45.80
2	A	3630	3630	76.34
3	A	3197	3197	2.06
4	A	3120	3120	10.24
5	A	3057	3057	16.08
6	A	1662	1662	176.00
7	A	1510	1510	8.99
8	A	1503	1503	18.07
9	A	1429	1429	78.36
10	A	1407	1407	254.22
11	A	1354	1354	21.95
12	A	1054	1054	1.24
13	A	1032	1032	32.96
14	A	1013	1013	13.80
15	A	748	748	8.50
16	A	623	623	6.11
17	A	520	520	4.26
18	A	428	428	0.91
19	A	378	378	2.68
20	A	259	259	168.66
21	A	44	44	0.09

Atom	x (Å)	y (Å)	z (Å)
C1	0.274	0.060	-0.007
S2	-1.363	-0.114	0.000
C3	1.232	-1.105	-0.000
N4	0.879	1.261	-0.002
H5	0.698	-2.030	-0.183
H6	2.004	-0.972	-0.760
H7	1.721	-1.165	0.974
H8	1.877	1.346	-0.001
H9	0.315	2.091	0.020

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6462	1.5079	1.3448	2.1395	2.1501	2.1346	2.0553	2.0312
S2	1.6462		2.7771	2.6298	2.8192	3.5565	3.4002	3.5540	2.7708
C3	1.5079	2.7771		2.3924	1.0835	1.0916	1.0917	2.5348	3.3244
N4	1.3448	2.6298	2.3924		3.3010	2.6128	2.7472	1.0022	1.0028
H5	2.1395	2.8192	1.0835	3.3010		1.7774	1.7705	3.5809	4.1430
H6	2.1501	3.5565	1.0916	2.6128	1.7774		1.7673	2.4421	3.5828
H7	2.1346	3.4002	1.0917	2.7472	1.7705	1.7673		2.6984	3.6721
H8	2.0553	3.5540	2.5348	1.0022	3.5809	2.4421	2.6984		1.7303
H9	2.0312	2.7708	3.3244	1.0028	4.1430	3.5828	3.6721	1.7303

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.221	C1	C3	H6	110.585
C1	C3	H7	109.346	C1	N4	H8	121.579
C1	N4	H9	119.098	S2	C1	C3	123.337
S2	C1	N4	122.786	C3	C1	N4	113.872
H5	C3	H6	109.603	H5	C3	H7	108.958
H6	C3	H7	108.082	H8	N4	H9	119.313

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: CCSD/cc-pV(T+d)Z

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 CH3CSNH2 (Ethanethioamide)

using model chemistry: CCSD/cc-pV(T+d)Z

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)