Geometry & MOs

Info

ID:

428836

PubChem CID:

135168284

Reduced:

NH23C35 (2)

Stoich.:

AB23C35 (2)

Weight, g/mol:

1055.423949

ΔHf, kcal/mol:

314.21

Dipole, Da:

0.76

IP(EA), eV:

 -8.09(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-diphenyl-4b,8a-dihydrofluoren-4-yl)spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-4'-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3C=CC=CC3C4=C2C=CC=C4N(C5=CC=CC6=C5C7=CC=CC=C7C68C9=CC=CC=C9N1C2=CC=CC=C2C2=C1C8=CC=C2)C1=CC2=CC=CC=C2C2=CC=CC=C21)C1=CC=CC=C1

DOS

IR

Vibrations