Geometry & MOs

Info

ID:	376520
PubChem CID:	134222538
Reduced:	BrNC16H26 (1)
Stoich.:	ABC16D26 (1)
Weight, g/mol:	676.12811
ΔH_f, kcal/mol:	-29.96
Dipole, Da:	3.59
IP(EA), eV:	-8.53(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-[2-[4-[[2,5-dimethoxy-4-[(4-nitrophenyl)diazenyl]phenyl]diazenyl]-N-ethylanilino]ethoxy]benzoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCC1=C(C=CC(=C1)Br)N

DOS

IR

Vibrations