Geometry & MOs

Info

ID:	381575
PubChem CID:	134972354
Reduced:	N2O3C20H20 (1)
Stoich.:	A2B3C20D20 (1)
Weight, g/mol:	385.106256
ΔH_f, kcal/mol:	-37.29
Dipole, Da:	0.94
IP(EA), eV:	-8.47(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anilino-3-(4-nitroanilino)naphthalene-1,4-dione

Drug info:

PubChemData

Smile

COCCNC1=C(C(=O)C2=CC=CC=C2C1=O)NCC3=CC=CC=C3

DOS

IR

Vibrations