Geometry & MOs

Info

ID:

318656

PubChem CID:

126652626

Reduced:

N3H31C48 (1)

Stoich.:

A3B31C48 (1)

Weight, g/mol:

716.319149

ΔHf, kcal/mol:

238.73

Dipole, Da:

1.58

IP(EA), eV:

 -7.96(-0.56)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[2-[2-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C4=CC=CC=C42)C5=C(C=C3)C6=CC=CC=C6N5C7=CC=CC=C7C8=CC=CC=C8N9C1=CC=CC=C1C1=CC=CC=C19

DOS

IR

Vibrations