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	hartrees
Energy at 0K	-437.392651
Energy at 298.15K	-437.394006
HF Energy	-437.392651
Nuclear repulsion energy	43.255172

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3032	3009	23.33
2	A₁	1490	1479	6.05
3	A₁	978	971	10.30
4	B₁	997	990	66.08
5	B₂	3129	3106	18.15
6	B₂	1003	995	9.35

Atom	y (Å)	z (Å)
S1	0.000	0.608
C2	0.000	-1.071
H3	0.932	-1.650
H4	-0.932	-1.650

	S1	C2	H3	H4
S1		1.6792	2.4431	2.4431
C2	1.6792		1.0972	1.0972
H3	2.4431	1.0972		1.8638
H4	2.4431	1.0972	1.8638

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	121.859		S1	C2	H4	121.859
H3	C2	H4	116.283

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: BLYP/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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	S	0.069
2	C	-0.419
3	H	0.175
4	H	0.175

	x	y	z	Total
	0.000	0.000	-2.043	2.043
CHELPG
AIM
ESP

<r²>	31.933
(<r²>)^1/2	5.651

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: BLYP/6-31G

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)