Geometry & MOs

Info

ID:

318040

PubChem CID:

126648532

Reduced:

O3C25H46 (1)

Stoich.:

A3B25C46 (1)

Weight, g/mol:

1269.553901

ΔHf, kcal/mol:

-221.85

Dipole, Da:

6.13

IP(EA), eV:

 -9.95(0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-methyl-N-[3-[8-[4-(N-methylanilino)phenyl]-5-[4-[N-methyl-4-[4-(9-phenylcarbazol-1-yl)phenyl]anilino]phenyl]-9-phenylcarbazol-2-yl]phenyl]-N-phenylcarbazol-1-amine

Drug info:

PubChemData

Smile

CCCC(=O)CCCCCCCCCCCC(=O)CCCCCCCC(=O)C

DOS

IR

Vibrations