Geometry & MOs

Info

ID:

446783

PubChem CID:

135277673

Reduced:

NOH31C48 (1)

Stoich.:

ABC31D48 (1)

Weight, g/mol:

747.259586

ΔHf, kcal/mol:

172.58

Dipole, Da:

1.28

IP(EA), eV:

 -7.96(-0.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzothiophen-2-ylphenyl)-4-phenyl-N-[4-(4-phenyl-5a,9a-dihydrodibenzofuran-3-yl)phenyl]aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC4=C(C=C3)C5=CC=CC=C5C6=CC=CC=C64)C7=C(C8=C(C=C7)C9=CC=CC=C9O8)C1=CC=CC=C1

DOS

IR

Vibrations