Geometry & MOs

Info

ID:

377412

PubChem CID:

134223464

Reduced:

N2O2H36C57 (1)

Stoich.:

A2B2C36D57 (1)

Weight, g/mol:

664.215078

ΔHf, kcal/mol:

170.21

Dipole, Da:

2.72

IP(EA), eV:

 -8.19(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

11-phenyl-8-(11-phenyl-[1]benzofuro[3,2-b]carbazol-8-yl)-[1]benzofuro[3,2-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N4C5=C(C=C(C=C5)C6=CC7=C(C=C6)OC8=C7C=C9C1=CC=CC=C1N(C9=C8)C1=CC=CC=C1)C1=C4C=C2C(=C1)C1=CC=CC=C1O2)C

DOS

IR

Vibrations