Geometry & MOs

Info

ID:

429290

PubChem CID:

135169259

Reduced:

N6C23H26 (1)

Stoich.:

A6B23C26 (1)

Weight, g/mol:

1397.410579

ΔHf, kcal/mol:

93.0

Dipole, Da:

2.9

IP(EA), eV:

 -8.35(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-chloro-5-(7-phenylbenzo[g]carbazol-9-yl)phenyl]-7-[9-[3-chloro-5-(N-(4-phenylphenyl)anilino)phenyl]-7-(4-phenylphenyl)benzo[c]carbazol-3-yl]-N-phenyldibenzothiophen-2-amine

Drug info:

PubChemData

Smile

CN1CCC(CC1)NC2=C3C=C(C=CC3=NC=C2N)C4=CN(C5=C4C=CC=N5)C

DOS

IR

Vibrations