Geometry & MOs

Info

ID:

325415

PubChem CID:

126683172

Reduced:

SN2H28C44 (1)

Stoich.:

AB2C28D44 (1)

Weight, g/mol:

712.287849

ΔHf, kcal/mol:

209.68

Dipole, Da:

1.28

IP(EA), eV:

 -8.11(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[3-(15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),6,8(13),9,11-heptaen-15-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)naphthalen-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC4=C(C=C3)C5=CC=CC=C5S4)C6=CC=CC(=C6)N7C8=CC=CC9=C8C1=C(C=CC=C17)C=C9

DOS

IR

Vibrations