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	hartrees
Energy at 0K	-437.430810
Energy at 298.15K	-437.432170
HF Energy	-437.430810
Nuclear repulsion energy	44.363655

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2982	2965	33.83
2	A₁	1448	1440	9.94
3	A₁	1043	1038	12.98
4	B₁	993	988	33.11
5	B₂	3059	3042	10.93
6	B₂	969	964	3.27

Atom	y (Å)	z (Å)
S1	0.000	0.591
C2	0.000	-1.035
H3	0.927	-1.625
H4	-0.927	-1.625

	S1	C2	H3	H4
S1		1.6256	2.4019	2.4019
C2	1.6256		1.0992	1.0992
H3	2.4019	1.0992		1.8549
H4	2.4019	1.0992	1.8549

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	122.462		S1	C2	H4	122.462
H3	C2	H4	115.075

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: BLYP/6-31G(2df,p)

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	-0.145
2	C	-0.136
3	H	0.141
4	H	0.141

	x	y	z	Total
	0.000	0.000	-1.777	1.777
CHELPG
AIM
ESP

<r²>	30.793
(<r²>)^1/2	5.549

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: BLYP/6-31G(2df,p)

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)