Geometry & MOs

Info

ID:	28941
PubChem CID:	830804
Reduced:	NO2H21C22 (1)
Stoich.:	AB2C21D22 (1)
Weight, g/mol:	288.089878
ΔH_f, kcal/mol:	-20.87
Dipole, Da:	2.67
IP(EA), eV:	-8.96(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-naphthalen-1-ylisoindole-1,3-dione

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=CC4=C3N=CC=C4

DOS

IR

Vibrations