Geometry & MOs

Info

ID:	378028
PubChem CID:	134224096
Reduced:	O3N5C23H23 (1)
Stoich.:	A3B5C23D23 (1)
Weight, g/mol:	403.16444
ΔH_f, kcal/mol:	35.19
Dipole, Da:	4.8
IP(EA), eV:	-8.47(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[4-[[4-[2-hydroxyethyl(methyl)amino]phenyl]diazenyl]phenyl]diazenyl]benzoic acid

Drug info:

PubChemData

Smile

CN(CCO)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)C(=O)OC

DOS

IR

Vibrations