Geometry & MOs

Info

ID:	87856
PubChem CID:	49898010
Reduced:	NSCl2O6H17C21 (1)
Stoich.:	ABC2D6E17F21 (1)
Weight, g/mol:	513.056835
ΔH_f, kcal/mol:	-199.17
Dipole, Da:	4.84
IP(EA), eV:	-9.49(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2,6-dichlorophenyl)methyl]-5-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=C(C=CC=C3Cl)Cl)OCC(=O)O

DOS

IR

Vibrations