Geometry & MOs

Info

ID:	88107
PubChem CID:	49901498
Reduced:	NSCl2O4H19C25 (1)
Stoich.:	ABC2D4E19F25 (1)
Weight, g/mol:	480.950926
ΔH_f, kcal/mol:	-80.62
Dipole, Da:	7.58
IP(EA), eV:	-8.78(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methylidene]-3-[(3,4-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC(=C(C=C3)Cl)Cl)OCC4=CC=CC=C4

DOS

IR

Vibrations