Geometry & MOs

Info

ID:

440934

PubChem CID:

135232306

Reduced:

ON2H20C32 (1)

Stoich.:

AB2C20D32 (1)

Weight, g/mol:

584.225249

ΔHf, kcal/mol:

134.04

Dipole, Da:

5.08

IP(EA), eV:

 -8.63(-1.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

25-phenyl-9-(3-phenylphenyl)-9,25-diazaheptacyclo[15.11.0.02,10.03,8.011,16.018,26.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(26),19,21,23,27-tridecaene

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C4=CC=CC=C4C5=C3C6=C(C=C5)OC7=NC=NC=C67)C8=CC=CC=C8

DOS

IR

Vibrations