Geometry & MOs

Info

ID:

298211

PubChem CID:

117648051

Reduced:

N3H43C62 (1)

Stoich.:

A3B43C62 (1)

Weight, g/mol:

790.309647

ΔHf, kcal/mol:

287.39

Dipole, Da:

0.63

IP(EA), eV:

 -7.58(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-carbazol-9-yl-5,10-dinaphthalen-1-yl-N,N-diphenylindolo[3,2-b]indol-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=C(C=C3)N4C5=C(C=C(C=C5)N(C6=CC=CC=C6)C7=CC=CC=C7)C8=C4C9=CC=CC=C9N8C1=CC=C(C=C1)C1=CC=CC(=C1)C1=CC=CC=C1

DOS

IR

Vibrations