Geometry & MOs

Info

ID:	21405
PubChem CID:	588136
Reduced:	ClN3O3H12C17 (1)
Stoich.:	AB3C3D12E17 (1)
Weight, g/mol:	341.056719
ΔH_f, kcal/mol:	61.27
Dipole, Da:	8.47
IP(EA), eV:	-9.2(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-methoxyphenyl)-(4-nitronaphthalen-1-yl)diazene

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)[N+](=O)[O-])Cl

DOS

IR

Vibrations