Geometry & MOs

Info

ID:

428187

PubChem CID:

135166410

Reduced:

NH23C34 (2)

Stoich.:

AB23C34 (2)

Weight, g/mol:

965.376999

ΔHf, kcal/mol:

280.11

Dipole, Da:

1.27

IP(EA), eV:

 -8.02(-0.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[2-(3-phenylphenyl)phenyl]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]-2'-amine

Drug info:

PubChemData

Smile

CC1(C2=C(C3=CC=CC=C31)C(=CC=C2)N(C4=CC=CC=C4C5=CC=CC=C5C6=CC=CC7=CC=CC=C76)C8=CC=CC9=C8C1=CC=CC=C1C91C2=CC=CC=C2N2C3=CC=CC=C3C3=C2C1=CC=C3)C

DOS

IR

Vibrations