Geometry & MOs

Info

ID:

428264

PubChem CID:

135166748

Reduced:

N2H42C61 (1)

Stoich.:

A2B42C61 (1)

Weight, g/mol:

802.334799

ΔHf, kcal/mol:

270.53

Dipole, Da:

1.42

IP(EA), eV:

 -8.22(-0.38)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3N(C4=CC=CC=C4C5=CC=CC=C5)C6=CC=CC7=C6C8=CC=CC=C8C79C1=CC=CC=C1N(C1=CC=CC=C91)C1=CC=CC=C1

DOS

IR

Vibrations