Geometry & MOs

Info

ID:	378027
PubChem CID:	134224095
Reduced:	O2N5C23H23 (1)
Stoich.:	A2B5C23D23 (1)
Weight, g/mol:	417.18009
ΔH_f, kcal/mol:	86.84
Dipole, Da:	1.76
IP(EA), eV:	-8.28(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)N4CCOCC4

DOS

IR

Vibrations