Geometry & MOs

Info

ID:	86974
PubChem CID:	49890294
Reduced:	NSCl2O3H11C17 (1)
Stoich.:	ABC2D3E11F17 (1)
Weight, g/mol:	423.009884
ΔH_f, kcal/mol:	-71.44
Dipole, Da:	4.25
IP(EA), eV:	-9.13(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)/C=C\3/C(=O)NC(=O)S3)Cl)Cl

DOS

IR

Vibrations