Geometry & MOs

Info

ID:	87811
PubChem CID:	49897661
Reduced:	ClSN2O6C28H29 (1)
Stoich.:	ABC2D6E28F29 (1)
Weight, g/mol:	605.86072
ΔH_f, kcal/mol:	-175.05
Dipole, Da:	6.27
IP(EA), eV:	-8.7(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5Z)-5-[(2-hydroxy-3,5-diiodophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)Cl)CC=C)/C=C\3/C(=O)N(C(=O)S3)CC(=O)N4CCOCC4

DOS

IR

Vibrations