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	hartrees
Energy at 0K	-474.805613
Energy at 298.15K
HF Energy	-474.385241
Nuclear repulsion energy	77.891730

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	3192	3094	27.35	194.31	0.09	0.17
2	A₁	1808	1752	352.68	12.70	0.16	0.28
3	A₁	1375	1333	1.00	12.51	0.60	0.75
4	A₁	861	834	3.76	38.61	0.15	0.26
5	B₁	680	659	81.58	5.19	0.75	0.86
6	B₁	391	379	5.51	0.02	0.75	0.86
7	B₂	3298	3196	3.95	88.97	0.75	0.86
8	B₂	917	889	0.91	0.09	0.75	0.86
9	B₂	333	323	2.68	0.02	0.75	0.86

Atom	y (Å)	z (Å)
C1	0.000	-1.780
C2	0.000	-0.449
S3	0.000	1.127
H4	0.944	-2.326
H5	-0.944	-2.326

	C1	C2	S3	H4	H5
C1		1.3307	2.9062	1.0912	1.0912
C2	1.3307		1.5756	2.1015	2.1015
S3	2.9062	1.5756		3.5797	3.5797
H4	1.0912	2.1015	3.5797		1.8887
H5	1.0912	2.1015	3.5797	1.8887

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	S3	180.000		C2	C1	H4	120.067
C2	C1	H5	120.067		H4	C1	H5	119.867

All results from a given calculation for CH₂CS (Thioketene)

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

States and conformations

All results from a given calculation for CH₂CS (Thioketene)