Geometry & MOs

Info

ID:

298198

PubChem CID:

117648022

Reduced:

N3H37C56 (1)

Stoich.:

A3B37C56 (1)

Weight, g/mol:

922.378396

ΔHf, kcal/mol:

268.97

Dipole, Da:

1.46

IP(EA), eV:

 -7.54(-0.81)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]-5,10-bis(3-pyridin-3-ylphenyl)indolo[3,2-b]indol-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=CC=CC=C3C4=C2C5=C(N4C6=CC=C(C7=CC=CC=C76)C8=CC9=CC=CC=C9C1=CC=CC=C18)C=CC(=C5)N(C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations