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	hartrees
Energy at 0K	-474.812473
Energy at 298.15K
HF Energy	-474.385389
Nuclear repulsion energy	77.909164

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3180	3067	16.52
2	A₁	1829	1764	350.31
3	A₁	1399	1349	0.08
4	A₁	865	834	12.45
5	B₁	747	721	70.58
6	B₁	391	377	5.61
7	B₂	3280	3163	1.35
8	B₂	947	913	1.53
9	B₂	340	328	2.34

Atom	y (Å)	z (Å)
C1	0.000	-1.778
C2	0.000	-0.451
S3	0.000	1.126
H4	0.944	-2.327
H5	-0.944	-2.327

	C1	C2	S3	H4	H5
C1		1.3270	2.9039	1.0927	1.0927
C2	1.3270		1.5769	2.1008	2.1008
S3	2.9039	1.5769		3.5803	3.5803
H4	1.0927	2.1008	3.5803		1.8888
H5	1.0927	2.1008	3.5803	1.8888

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	S3	180.000		C2	C1	H4	120.193
C2	C1	H5	120.193		H4	C1	H5	119.613

All results from a given calculation for CH₂CS (Thioketene)

using model chemistry: CCD/aug-cc-pVDZ

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: CCD/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂CS (Thioketene)