Geometry & MOs

Info

ID:	10595
PubChem CID:	105280
Reduced:	O4N5H17C20 (1)
Stoich.:	A4B5C17D20 (1)
Weight, g/mol:	391.128054
ΔH_f, kcal/mol:	72.86
Dipole, Da:	5.9
IP(EA), eV:	-8.74(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-methoxy-5-methyl-4-[(4-nitrophenyl)diazenyl]phenyl]diazenyl]phenol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])OC)N=NC3=CC=C(C=C3)O

DOS

IR

Vibrations