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	hartrees
Energy at 0K	-474.982993
Energy at 298.15K
HF Energy	-474.419947
Nuclear repulsion energy	79.006487

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	3216	3059	31.65	190.50	0.09	0.17
2	A₁	1833	1744	368.42	14.13	0.20	0.33
3	A₁	1398	1330	0.99	13.10	0.58	0.74
4	A₁	873	831	4.36	37.45	0.13	0.23
5	B₁	701	667	78.30	5.27	0.75	0.86
6	B₁	440	418	7.98	0.03	0.75	0.86
7	B₂	3278	3118	5.81	85.01	0.75	0.86
8	B₂	949	903	0.68	0.07	0.75	0.86
9	B₂	359	342	2.75	0.00	0.75	0.86

Atom	y (Å)	z (Å)
C1	0.000	-1.753
C2	0.000	-0.444
S3	0.000	1.111
H4	0.931	-2.293
H5	-0.931	-2.293

	C1	C2	S3	H4	H5
C1		1.3093	2.8643	1.0762	1.0762
C2	1.3093		1.5550	2.0704	2.0704
S3	2.8643	1.5550		3.5292	3.5292
H4	1.0762	2.0704	3.5292		1.8619
H5	1.0762	2.0704	3.5292	1.8619

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	S3	180.000		C2	C1	H4	120.115
C2	C1	H5	120.115		H4	C1	H5	119.769

All results from a given calculation for CH₂CS (Thioketene)

using model chemistry: MP2=FULL/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: MP2=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂CS (Thioketene)