Geometry & MOs

Info

ID:

377397

PubChem CID:

134223448

Reduced:

NOH14C24 (2)

Stoich.:

ABC14D24 (2)

Weight, g/mol:

690.267114

ΔHf, kcal/mol:

158.22

Dipole, Da:

2.29

IP(EA), eV:

 -8.05(-0.7)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

10-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC5=C(C=C4)N(C6=C5C=C7C8=CC=CC=C8OC7=C6)C9=CC=CC=C9)C1=C2C=C2C(=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations