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	hartrees
Energy at 0K	-531.438488
Energy at 298.15K
HF Energy	-530.691573
Nuclear repulsion energy	155.389411

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3768	3553	47.04
2	A	3632	3426	73.81
3	A	3196	3015	1.73
4	A	3118	2940	7.84
5	A	3054	2880	15.98
6	A	1673	1578	170.13
7	A	1512	1426	7.81
8	A	1507	1422	15.12
9	A	1432	1351	53.64
10	A	1406	1326	323.53
11	A	1355	1278	19.13
12	A	1051	991	0.55
13	A	1035	976	39.92
14	A	1016	958	10.86
15	A	749	706	8.42
16	A	615	580	4.23
17	A	523	493	4.29
18	A	431	407	0.80
19	A	382	360	2.07
20	A	312	294	168.59
21	A	31	30	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.273	0.059	0.000
S2	-1.362	-0.117	-0.000
C3	1.236	-1.103	0.000
N4	0.873	1.263	0.000
H5	0.694	-2.041	0.001
H6	1.876	-1.056	-0.885
H7	1.877	-1.055	0.884
H8	1.873	1.352	-0.000
H9	0.310	2.095	-0.000

	C1	S2	C3	N4	H5	H6	H7	H8	H9
C1		1.6452	1.5088	1.3452	2.1423	2.1433	2.1434	2.0568	2.0361
S2	1.6452		2.7790	2.6274	2.8162	3.4855	3.4862	3.5533	2.7732
C3	1.5088	2.7790		2.3936	1.0842	1.0925	1.0925	2.5360	3.3289
N4	1.3452	2.6274	2.3936		3.3096	2.6773	2.6767	1.0037	1.0043
H5	2.1423	2.8162	1.0842	3.3096		1.7750	1.7751	3.5926	4.1542
H6	2.1433	3.4855	1.0925	2.6773	1.7750		1.7681	2.5657	3.6281
H7	2.1434	3.4862	1.0925	2.6767	1.7751	1.7681		2.5647	3.6278
H8	2.0568	3.5533	2.5360	1.0037	3.5926	2.5657	2.5647		1.7304
H9	2.0361	2.7732	3.3289	1.0043	4.1542	3.6281	3.6278	1.7304

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	110.350	C1	C3	H6	109.933
C1	C3	H7	109.938	C1	N4	H8	121.553
C1	N4	H9	119.422	S2	C1	C3	123.493
S2	C1	N4	122.630	C3	C1	N4	113.877
H5	C3	H6	109.269	H5	C3	H7	109.272
H6	C3	H7	108.037	H8	N4	H9	119.026

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)

using model chemistry: CCSD/6-311+G(3df,2p)

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/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₃CSNH₂ (Ethanethioamide)