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	hartrees
Energy at 0K	-437.216764
Energy at 298.15K	-437.218151
HF Energy	-437.216764
Nuclear repulsion energy	43.854695

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3150	3011	13.58
2	A₁	1537	1469	2.70
3	A₁	1056	1009	12.44
4	B₁	1054	1008	79.69
5	B₂	3256	3113	7.88
6	B₂	1045	999	9.80

Atom	y (Å)	z (Å)
S1	0.000	0.599
C2	0.000	-1.055
H3	0.925	-1.628
H4	-0.925	-1.628

	S1	C2	H3	H4
S1		1.6540	2.4118	2.4118
C2	1.6540		1.0886	1.0886
H3	2.4118	1.0886		1.8509
H4	2.4118	1.0886	1.8509

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	121.775		S1	C2	H4	121.775
H3	C2	H4	116.450

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: PBE1PBE/6-31G

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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Number	Element	Mulliken
1	S	0.093
2	C	-0.529
3	H	0.218
4	H	0.218

	x	y	z	Total
	0.000	0.000	-2.164	2.164
CHELPG
AIM
ESP

<r²>	31.375
(<r²>)^1/2	5.601

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: PBE1PBE/6-31G

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)