Geometry & MOs

Info

ID:	88010
PubChem CID:	49899720
Reduced:	NS2Cl3O6H18C25 (1)
Stoich.:	AB2C3D6E18F25 (1)
Weight, g/mol:	488.8854
ΔH_f, kcal/mol:	-174.89
Dipole, Da:	7.07
IP(EA), eV:	-9.03(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2,6-dichlorophenyl)methyl]-5-[(2-iodophenyl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC(=C(C=C3)Cl)Cl)Cl)OS(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations