Geometry & MOs

Info

ID:	171179
PubChem CID:	75339629
Reduced:	NSCl3O5H8C13 (1)
Stoich.:	ABC3D5E8F13 (1)
Weight, g/mol:	496.99465
ΔH_f, kcal/mol:	-187.32
Dipole, Da:	2.13
IP(EA), eV:	-9.57(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-iodophenyl)methyl]-5-[(4-phenylphenyl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC(=O)CN1C(=O)C(=CC2=C(C(=C(C=C2Cl)Cl)O)Cl)SC1=O

DOS

IR

Vibrations