Geometry & MOs

Info

ID:

377692

PubChem CID:

134223756

Reduced:

ON2H34C51 (1)

Stoich.:

AB2C34D51 (1)

Weight, g/mol:

690.267114

ΔHf, kcal/mol:

176.71

Dipole, Da:

3.54

IP(EA), eV:

 -8.03(-0.89)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-(12,12-dimethyl-5-phenylindeno[2,1-g]carbazol-3-yl)-11-phenyl-[1]benzofuro[3,2-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=C(C3=CC=CC=C31)C4=C(C=C2)N(C5=C4C=CC(=C5)C6=CC7=C(C=C6)N(C8=C7C=C9C(=C8)C1=CC=CC=C1O9)C1=CC=CC=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations