Geometry & MOs

Info

ID:	378111
PubChem CID:	134224183
Reduced:	O3N5H23C24 (1)
Stoich.:	A3B5C23D24 (1)
Weight, g/mol:	447.190654
ΔH_f, kcal/mol:	41.84
Dipole, Da:	4.8
IP(EA), eV:	-8.49(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations