Geometry & MOs

Info

ID:	46309
PubChem CID:	10523823
Reduced:	NO2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	380.196074
ΔH_f, kcal/mol:	-117.76
Dipole, Da:	3.33
IP(EA), eV:	-9.63(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[[2-[[(4-acetylphenyl)diazenyl]-methylamino]ethyl-methylamino]diazenyl]phenyl]ethanone

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OC)NC(=O)[C@@]1(CC(=O)N1CC2=CC=CC=C2)CC3=CC=CC=C3

DOS

IR

Vibrations