Geometry & MOs

Info

ID:	88127
PubChem CID:	49901782
Reduced:	NSCl2O3H19C24 (1)
Stoich.:	ABC2D3E19F24 (1)
Weight, g/mol:	502.991648
ΔH_f, kcal/mol:	-70.76
Dipole, Da:	4.64
IP(EA), eV:	-8.85(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-3-[(3,4-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)OC1=C(C2=CC=CC=C2C=C1)/C=C\3/C(=O)N(C(=O)S3)CC4=CC(=C(C=C4)Cl)Cl

DOS

IR

Vibrations