Geometry & MOs

Info

ID:

298828

PubChem CID:

117659514

Reduced:

NOH25C39 (2)

Stoich.:

ABC25D39 (2)

Weight, g/mol:

640.226312

ΔHf, kcal/mol:

288.04

Dipole, Da:

1.23

IP(EA), eV:

 -7.78(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=C(C=C2)N(C3=CC=CC4=C3OC5=CC=CC=C45)C6=CC7=C(C=C(C8=CC=CC=C87)N(C9=C(C=C(C=C9)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC2=C1OC1=CC=CC=C21)C1=CC=CC=C16)C1=CC=CC=C1

DOS

IR

Vibrations