Geometry & MOs

Info

ID:

426437

PubChem CID:

135144177

Reduced:

ON4H36C57 (1)

Stoich.:

AB4C36D57 (1)

Weight, g/mol:

600.231397

ΔHf, kcal/mol:

258.06

Dipole, Da:

0.62

IP(EA), eV:

 -8.22(-1.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-naphthalen-1-yl-9-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC=C2C3=CC4=C(C=C3)C5=CC=CC=C5N4C6=CC=CC(=C6)C7=CC(=CC=C7)C8=NC(=NC(=N8)C9=CC=CC=C9)C1=CC2=C(C=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations