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	hartrees
Energy at 0K	-436.534062
Energy at 298.15K	-436.535485
HF Energy	-436.534062
Nuclear repulsion energy	44.975068

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3252	2961	26.30
2	A₁	1606	1463	3.30
3	A₁	1169	1065	34.99
4	B₁	1151	1048	43.64
5	B₂	3348	3049	2.05
6	B₂	1068	973	1.27

Atom	y (Å)	z (Å)
S1	0.000	0.582
C2	0.000	-1.021
H3	0.921	-1.595
H4	-0.921	-1.595

	S1	C2	H3	H4
S1		1.6039	2.3643	2.3643
C2	1.6039		1.0852	1.0852
H3	2.3643	1.0852		1.8426
H4	2.3643	1.0852	1.8426

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	121.902		S1	C2	H4	121.902
H3	C2	H4	116.196

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: HF/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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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	0.139
2	C	0.065
3	H	-0.102
4	H	-0.102

	x	y	z	Total
	0.000	0.000	-2.199	2.199
CHELPG
AIM
ESP

<r²>	30.573
(<r²>)^1/2	5.529

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: HF/aug-cc-pVDZ

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)