Geometry & MOs

Info

ID:	381422
PubChem CID:	134972148
Reduced:	ClN2O2H15C22 (1)
Stoich.:	AB2C2D15E22 (1)
Weight, g/mol:	372.111007
ΔH_f, kcal/mol:	28.56
Dipole, Da:	1.48
IP(EA), eV:	-8.16(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dianilino-5,8-dihydroxynaphthalene-1,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC2=C(C(=O)C3=C(C2=O)C=CC=C3Cl)NC4=CC=CC=C4

DOS

IR

Vibrations