Geometry & MOs

Info

ID:	23721
PubChem CID:	605526
Reduced:	NSO3H11C13 (1)
Stoich.:	ABC3D11E13 (1)
Weight, g/mol:	261.045964
ΔH_f, kcal/mol:	-73.47
Dipole, Da:	4.66
IP(EA), eV:	-9.21(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-hydroxy-3-prop-2-enylphenyl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C=CCC1=C(C(=CC=C1)C=C2C(=O)NC(=O)S2)O

DOS

IR

Vibrations