Geometry & MOs

Info

ID:

449541

PubChem CID:

135299434

Reduced:

NH43C65 (1)

Stoich.:

AB43C65 (1)

Weight, g/mol:

673.27695

ΔHf, kcal/mol:

275.55

Dipole, Da:

1.49

IP(EA), eV:

 -8.03(-0.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-phenanthren-2-yl-N-(3-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C2C=C(C=C4)N(C5=CC=CC=C5C6=CC7=C(C=C6)C8=CC=CC=C8C=C7)C9=CC=CC=C9C1=CC2=C(C=C1)C1=CC=CC=C1C=C2)C1=CC=CC=C1

DOS

IR

Vibrations