Geometry & MOs

Info

ID:	79639
PubChem CID:	49829811
Reduced:	N3O4C24H25 (1)
Stoich.:	A3B4C24D25 (1)
Weight, g/mol:	419.082744
ΔH_f, kcal/mol:	-102.8
Dipole, Da:	5.87
IP(EA), eV:	-8.95(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]-3-(naphthalen-1-ylmethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C1=CC2=CC=CC=C2C=C1)NC(=O)COC(=O)C3=CN=C(C=C3)N4CCOCC4

DOS

IR

Vibrations