Geometry & MOs

Info

ID:

327772

PubChem CID:

126691037

Reduced:

ON2H38C53 (1)

Stoich.:

AB2C38D53 (1)

Weight, g/mol:

890.366099

ΔHf, kcal/mol:

209.53

Dipole, Da:

1.92

IP(EA), eV:

 -7.8(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-(9,10-dihydrophenanthren-1-yl)phenyl]-N-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]triphenylen-2-amine

Drug info:

PubChemData

Smile

C/C=C\C=C(/C=C)\N1C2=C(C=C(C=C2)C3=CC=C(C=C3)N(C4=CC=C(C=C4)C5=CC=CC6=C5OC7=CC=CC=C67)C8=CC9=CC=CC=C9C=C8)C2=CC=CC=C21

DOS

IR

Vibrations