Geometry & MOs

Info

ID:

378333

PubChem CID:

134224411

Reduced:

ClN3O3C9H12 (1)

Stoich.:

AB3C3D9E12 (1)

Weight, g/mol:

1553.616501

ΔHf, kcal/mol:

-118.96

Dipole, Da:

4.49

IP(EA), eV:

-9.62(-0.38)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-[9-[3-[3-[3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]phenyl]carbazol-2-yl]-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine

Drug info:

PubChemData

Smile

C1C(OC(C1Cl)N2C=CC(=NC2=O)N)CO

DOS

IR

Vibrations