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	hartrees
Energy at 0K	-474.932056
Energy at 298.15K
HF Energy	-474.419569
Nuclear repulsion energy	78.623637

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3180	3060	19.85
2	A₁	1823	1754	363.45
3	A₁	1405	1352	0.03
4	A₁	851	819	15.76
5	B₁	743	715	69.89
6	B₁	415	399	6.04
7	B₂	3269	3146	2.60
8	B₂	953	917	0.98
9	B₂	357	344	2.08

Atom	y (Å)	z (Å)
C1	0.000	-1.761
C2	0.000	-0.449
S3	0.000	1.117
H4	0.934	-2.304
H5	-0.934	-2.304

	C1	C2	S3	H4	H5
C1		1.3114	2.8771	1.0804	1.0804
C2	1.3114		1.5658	2.0764	2.0764
S3	2.8771	1.5658		3.5455	3.5455
H4	1.0804	2.0764	3.5455		1.8679
H5	1.0804	2.0764	3.5455	1.8679

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	S3	180.000		C2	C1	H4	120.181
C2	C1	H5	120.181		H4	C1	H5	119.638

All results from a given calculation for CH₂CS (Thioketene)

using model chemistry: QCISD/aug-cc-pVTZ

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/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂CS (Thioketene)