Geometry & MOs

Info

ID:	88501
PubChem CID:	49903916
Reduced:	SN3O8C25H25 (1)
Stoich.:	AB3C8D25E25 (1)
Weight, g/mol:	384.077993
ΔH_f, kcal/mol:	-179.02
Dipole, Da:	4.57
IP(EA), eV:	-9.26(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(2-ethoxyphenyl)methylidene]-3-[(2-nitrophenyl)methyl]-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=CC=CC=C3[N+](=O)[O-])OCC(=O)N4CCOCC4

DOS

IR

Vibrations