Geometry & MOs

Info

ID:	302766
PubChem CID:	124394907
Reduced:	OSCl2N4C21H22 (1)
Stoich.:	ABC2D4E21F22 (1)
Weight, g/mol:	485.015843
ΔH_f, kcal/mol:	15.34
Dipole, Da:	4.36
IP(EA), eV:	-8.92(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[(5Z)-5-[[2-(4-chlorophenyl)sulfanylphenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CCN1C(=NN=C1SCC2=CC(=C(C=C2)Cl)Cl)[C@H](C)NC(=O)C3=CC=CC(=C3)C

DOS

IR

Vibrations