Geometry & MOs

Info

ID:

428269

PubChem CID:

135166753

Reduced:

N2H42C61 (1)

Stoich.:

A2B42C61 (1)

Weight, g/mol:

852.350449

ΔHf, kcal/mol:

265.63

Dipole, Da:

2.63

IP(EA), eV:

 -7.99(-0.39)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-naphthalen-1-ylphenyl)-10-phenyl-N-[2-(3-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC=CC=C3C4=CC=CC(=C4)C5=CC=CC=C5)C6=CC=CC7=C6C8=CC=CC=C8C79C1=CC=CC=C1N(C1=CC=CC=C91)C1=CC=CC=C1

DOS

IR

Vibrations