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	hartrees
Energy at 0K	-472.205333
Energy at 298.15K
HF Energy	-471.974131
Nuclear repulsion energy	77.370077

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3201	2982	18.81
2	A₁	1867	1740	239.63
3	A₁	1492	1390	0.23
4	A₁	816	760	16.97
5	B₁	887	826	98.47
6	B₁	418	389	4.03
7	B₂	3276	3052	1.29
8	B₂	1034	963	0.03
9	B₂	355	331	3.58

Atom	y (Å)	z (Å)
C1	0.000	-1.780
C2	0.000	-0.476
S3	0.000	1.139
H4	0.928	-2.340
H5	-0.928	-2.340

	C1	C2	S3	H4	H5
C1		1.3036	2.9186	1.0843	1.0843
C2	1.3036		1.6149	2.0822	2.0822
S3	2.9186	1.6149		3.6005	3.6005
H4	1.0843	2.0822	3.6005		1.8569
H5	1.0843	2.0822	3.6005	1.8569

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	S3	180.000		C2	C1	H4	121.103
C2	C1	H5	121.103		H4	C1	H5	117.794

All results from a given calculation for CH₂CS (Thioketene)

using model chemistry: CID/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 CH2CS (Thioketene)

using model chemistry: CID/3-21G

States and conformations

All results from a given calculation for CH₂CS (Thioketene)