Geometry & MOs

Info

ID:

377615

PubChem CID:

134223678

Reduced:

ON2H34C51 (1)

Stoich.:

AB2C34D51 (1)

Weight, g/mol:

690.267114

ΔHf, kcal/mol:

174.61

Dipole, Da:

3.14

IP(EA), eV:

 -8.09(-0.89)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(12,12-dimethyl-5-phenylindeno[1,2-c]carbazol-2-yl)-12-phenyl-[1]benzofuro[2,3-a]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)N(C5=C4C=C(C=C5)C6=CC7=C(C=C6)C8=C(N7C9=CC=CC=C9)C=C1C2=CC=CC=C2OC1=C8)C1=CC=CC=C1)C

DOS

IR

Vibrations