Geometry & MOs

Info

ID:

428942

PubChem CID:

135168468

Reduced:

NH22C34 (2)

Stoich.:

AB22C34 (2)

Weight, g/mol:

888.350449

ΔHf, kcal/mol:

305.83

Dipole, Da:

0.98

IP(EA), eV:

 -8.09(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(9,9-diphenylfluoren-2-yl)-N-(2-phenylphenyl)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]-3'-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)N(C3=CC4=C(C=C3)C5(C6=CC=CC=C64)C7=CC=CC=C7N8C9=CC=CC=C9C1=C8C5=CC=C1)C1=CC2=C(C=C1)C1=CC=CC=C1C2(C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations