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	hartrees
Energy at 0K	-469.221606
Energy at 298.15K
HF Energy	-469.043785
Nuclear repulsion energy	77.903591

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3442	3059	52.47	59.20	0.12	0.22
2	A₁	1972	1753	101.84	1.36	0.06	0.11
3	A₁	1580	1405	0.06	19.88	0.69	0.81
4	A₁	903	802	0.12	12.22	0.30	0.47
5	B₁	734	652	43.59	0.02	0.75	0.86
6	B₁	402	357	1.04	0.42	0.75	0.86
7	B₂	3588	3190	1.68	60.21	0.75	0.86
8	B₂	1070	951	0.11	0.08	0.75	0.86
9	B₂	342	304	0.24	0.10	0.75	0.86

Atom	y (Å)	z (Å)
C1	0.000	-1.778
C2	0.000	-0.443
S3	0.000	1.126
H4	0.938	-2.346
H5	-0.938	-2.346

	C1	C2	S3	H4	H5
C1		1.3347	2.9044	1.0964	1.0964
C2	1.3347		1.5697	2.1210	2.1210
S3	2.9044	1.5697		3.5965	3.5965
H4	1.0964	2.1210	3.5965		1.8761
H5	1.0964	2.1210	3.5965	1.8761

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	S3	180.000		C2	C1	H4	121.179
C2	C1	H5	121.179		H4	C1	H5	117.642

All results from a given calculation for CH₂CS (Thioketene)

using model chemistry: MP2=FULL/STO-3G

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 CH2CS (Thioketene)

using model chemistry: MP2=FULL/STO-3G

States and conformations

All results from a given calculation for CH₂CS (Thioketene)