Geometry & MOs

Info

ID:	88033
PubChem CID:	49900048
Reduced:	NSCl2O5H21C26 (1)
Stoich.:	ABC2D5E21F26 (1)
Weight, g/mol:	720.82391
ΔH_f, kcal/mol:	-122.34
Dipole, Da:	4.19
IP(EA), eV:	-8.92(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC(=C(C=C3)Cl)Cl)OCCOC4=CC=CC=C4

DOS

IR

Vibrations