Geometry & MOs

Info

ID:

428117

PubChem CID:

135166138

Reduced:

N2H16C25 (2)

Stoich.:

A2B16C25 (2)

Weight, g/mol:

778.273262

ΔHf, kcal/mol:

254.98

Dipole, Da:

3.23

IP(EA), eV:

-8.04(-1.13)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-(4-dibenzofuran-3-ylquinazolin-2-yl)-12-(3,5-diphenylphenyl)indolo[3,2-c]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NC4=CC=CC=C43)N5C6=C(C7=CC=CC=C75)C8=C(C=C6)C9=CC=CC=C9N8C1=CC=CC(=C1)C1=CC=CC=C1

DOS

IR

Vibrations