Geometry & MOs

Info

ID:

298201

PubChem CID:

117648027

Reduced:

N3H39C58 (1)

Stoich.:

A3B39C58 (1)

Weight, g/mol:

866.340947

ΔHf, kcal/mol:

275.06

Dipole, Da:

0.7

IP(EA), eV:

 -7.59(-0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-carbazol-9-yl-5-naphthalen-2-yl-N,N-diphenyl-10-(4-phenylnaphthalen-1-yl)indolo[3,2-b]indol-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC4=C(C=C3)N(C5=C4N(C6=CC=CC=C65)C7=CC=C(C=C7)C8=CC=CC9=CC=CC=C98)C1=CC=C(C=C1)C1=CC=CC2=CC=CC=C21

DOS

IR

Vibrations