Geometry & MOs

Info

ID:

325430

PubChem CID:

126683229

Reduced:

NH17C25 (2)

Stoich.:

AB17C25 (2)

Weight, g/mol:

814.334799

ΔHf, kcal/mol:

228.28

Dipole, Da:

0.73

IP(EA), eV:

 -8.08(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[3-(3,10-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaen-15-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)N(C3=CC=CC(=C3)C4=CC=CC=C4)C5=CC=CC(=C5)C6=CC(=CC=C6)N7C8=CC=CC9=C8C1=C(C=CC=C17)C=C9

DOS

IR

Vibrations