Geometry & MOs

Info

ID:	438570
PubChem CID:	135228314
Reduced:	NO4C21H21 (1)
Stoich.:	AB4C21D21 (1)
Weight, g/mol:	395.99709
ΔH_f, kcal/mol:	-137.14
Dipole, Da:	4.01
IP(EA), eV:	-8.47(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-[2-(iodomethoxy)ethyl]benzo[de]isoquinoline-1,3-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31

DOS

IR

Vibrations