Geometry & MOs

Info

ID:

428125

PubChem CID:

135166178

Reduced:

N2H17C28 (2)

Stoich.:

A2B17C28 (2)

Weight, g/mol:

762.278347

ΔHf, kcal/mol:

274.09

Dipole, Da:

3.3

IP(EA), eV:

 -7.96(-1.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

12-[4-(4-phenylphenyl)quinazolin-2-yl]-5-triphenylen-2-ylindolo[3,2-c]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)N5C6=CC=CC=C6C7=C5C8=C(C=C7)N(C9=CC=CC=C98)C1=CC2=C(C=C1)C1=CC=CC=C1C1=CC=CC=C12

DOS

IR

Vibrations