Geometry & MOs

Info

ID:

318657

PubChem CID:

126652631

Reduced:

NH20C27 (2)

Stoich.:

AB20C27 (2)

Weight, g/mol:

716.319149

ΔHf, kcal/mol:

193.21

Dipole, Da:

2.63

IP(EA), eV:

 -8.03(-0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

12-[2-[2-(7,7-dimethylindeno[1,2-a]carbazol-12-yl)phenyl]phenyl]-7,7-dimethylindeno[1,2-a]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=CC=CC=C5N4C6=CC=CC=C6C7=CC=CC=C7N8C9=CC=CC=C9C1=CC2=C(C=C18)C(C1=CC=CC=C12)(C)C)C

DOS

IR

Vibrations