Geometry & MOs

Info

ID:

446746

PubChem CID:

135277389

Reduced:

NOH37C54 (1)

Stoich.:

ABC37D54 (1)

Weight, g/mol:

745.243936

ΔHf, kcal/mol:

198.96

Dipole, Da:

1.86

IP(EA), eV:

 -8.06(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzothiophen-4-ylphenyl)-4-phenyl-N-[4-(4-phenyldibenzofuran-3-yl)phenyl]aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)N(C4=C(C5=C(C=C4)C6=CC=CC=C6O5)C7=CC=C(C=C7)C8=CC=CC=C8)C9=CC=CC=C9C1=CC=CC=C1

DOS

IR

Vibrations