Geometry & MOs

Info

ID:	87245
PubChem CID:	49893429
Reduced:	NSCl2O5H13C19 (1)
Stoich.:	ABC2D5E13F19 (1)
Weight, g/mol:	469.03062
ΔH_f, kcal/mol:	-155.74
Dipole, Da:	4.97
IP(EA), eV:	-9.76(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OCC(=O)O)/C=C\2/C(=O)N(C(=O)S2)CC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations