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	hartrees
Energy at 0K	-437.515193
Energy at 298.15K	-437.516577
HF Energy	-437.515193
Nuclear repulsion energy	44.763011

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3058	2951	34.71
2	A₁	1500	1447	4.54
3	A₁	1092	1054	14.01
4	B₁	1031	995	40.11
5	B₂	3139	3030	5.82
6	B₂	1002	967	1.98

Atom	y (Å)	z (Å)
S1	0.000	0.585
C2	0.000	-1.026
H3	0.923	-1.605
H4	-0.923	-1.605

	S1	C2	H3	H4
S1		1.6117	2.3766	2.3766
C2	1.6117		1.0892	1.0892
H3	2.3766	1.0892		1.8458
H4	2.3766	1.0892	1.8458

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	122.077		S1	C2	H4	122.077
H3	C2	H4	115.846

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: TPSSh/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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Number	Element	Mulliken
1	S	-0.085
2	C	-0.479
3	H	0.282
4	H	0.282

	x	y	z	Total
	0.000	0.000	-1.807	1.807
CHELPG
AIM
ESP

<r²>	30.598
(<r²>)^1/2	5.532

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: TPSSh/aug-cc-pVTZ

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)