Geometry & MOs

Info

ID:

439440

PubChem CID:

135229214

Reduced:

N3H17C22 (2)

Stoich.:

A3B17C22 (2)

Weight, g/mol:

618.253195

ΔHf, kcal/mol:

202.5

Dipole, Da:

3.48

IP(EA), eV:

 -7.63(-0.97)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[9-[3-[9-(4-aminophenyl)-1,10-phenanthrolin-2-yl]phenyl]-3,4-dihydro-1,10-phenanthrolin-2-yl]aniline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC3=C(C=CC4=CC=C(NC43C)C5=CC(=CC(=C5)C6=NC7=C(C=CC8=C7N=C(C=C8)C9=CC=C(C=C9)N)C=C6)N)C=C2

DOS

IR

Vibrations