Geometry & MOs

Info

ID:

377708

PubChem CID:

134223772

Reduced:

NOH14C24 (2)

Stoich.:

ABC14D24 (2)

Weight, g/mol:

690.267114

ΔHf, kcal/mol:

165.05

Dipole, Da:

3.05

IP(EA), eV:

 -8.1(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)-12-phenyl-[1]benzofuro[2,3-a]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C4=C2C=C(C=C4)C5=CC6=C(C=C5)N(C7=C6C=CC8=C7OC9=CC=CC=C89)C1=CC=CC=C1)C1=C(C=C3)OC2=CC=CC=C21

DOS

IR

Vibrations