Geometry & MOs

Info

ID:	86852
PubChem CID:	49889707
Reduced:	FNSO3H18C20 (1)
Stoich.:	ABCD3E18F20 (1)
Weight, g/mol:	497.086385
ΔH_f, kcal/mol:	-116.68
Dipole, Da:	5.92
IP(EA), eV:	-8.93(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-chloro-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F

DOS

IR

Vibrations