Geometry & MOs

Info

ID:

377302

PubChem CID:

134223350

Reduced:

ON2H34C51 (1)

Stoich.:

AB2C34D51 (1)

Weight, g/mol:

680.192235

ΔHf, kcal/mol:

173.91

Dipole, Da:

2.44

IP(EA), eV:

 -8.05(-0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C5=C(C=C(C=C5)C6=CC7=C(C=C6)N(C8=C7C=C9C(=C8)C1=CC=CC=C1O9)C1=CC=CC=C1)N(C4=C3)C1=CC=CC=C1)C

DOS

IR

Vibrations