Geometry & MOs

Info

ID:	88131
PubChem CID:	49901809
Reduced:	NSCl2O5H17C25 (1)
Stoich.:	ABC2D5E17F25 (1)
Weight, g/mol:	502.991648
ΔH_f, kcal/mol:	-117.63
Dipole, Da:	4.2
IP(EA), eV:	-9.09(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]-3-[(3,4-dichlorophenyl)methyl]-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)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations