Geometry & MOs

Info

ID:	87850
PubChem CID:	49897955
Reduced:	NSCl2O3H11C17 (1)
Stoich.:	ABC2D3E11F17 (1)
Weight, g/mol:	573.033512
ΔH_f, kcal/mol:	-52.2
Dipole, Da:	2.83
IP(EA), eV:	-9.05(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[4-[(4-chlorophenyl)methoxy]-3-methoxy-5-prop-2-enylphenyl]methylidene]-3-[(2,6-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CN2C(=O)/C(=C/C=C/C3=CC=CO3)/SC2=O)Cl

DOS

IR

Vibrations