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	hartrees
Energy at 0K	-474.857281
Energy at 298.15K
HF Energy	-474.371916
Nuclear repulsion energy	78.641955

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3209	3040	23.65
2	A₁	1854	1756	296.61
3	A₁	1408	1334	0.02
4	A₁	852	807	17.47
5	B₁	752	713	69.22
6	B₁	429	406	2.20
7	B₂	3303	3129	3.32
8	B₂	960	910	0.11
9	B₂	368	349	1.27

Atom	y (Å)	z (Å)
C1	0.000	-1.759
C2	0.000	-0.449
S3	0.000	1.116
H4	0.933	-2.306
H5	-0.933	-2.306

	C1	C2	S3	H4	H5
C1		1.3101	2.8755	1.0820	1.0820
C2	1.3101		1.5653	2.0787	2.0787
S3	2.8755	1.5653		3.5477	3.5477
H4	1.0820	2.0787	3.5477		1.8669
H5	1.0820	2.0787	3.5477	1.8669

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	S3	180.000		C2	C1	H4	120.378
C2	C1	H5	120.378		H4	C1	H5	119.243

All results from a given calculation for CH₂CS (Thioketene)

using model chemistry: QCISD/6-31G(2df,p)

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: QCISD/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₂CS (Thioketene)