Geometry & MOs

Info

ID:

429148

PubChem CID:

135168939

Reduced:

NH21C33 (2)

Stoich.:

AB21C33 (2)

Weight, g/mol:

964.38175

ΔHf, kcal/mol:

295.31

Dipole, Da:

1.04

IP(EA), eV:

 -7.9(-0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9,9-diphenyl-N-(4-phenylphenyl)-N-(4-spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-17-ylphenyl)fluoren-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C2C=C(C=C4)N(C5=CC6=C(C=C5)C7=CC=CC=C7C68C9=CC=CC=C9N1C2=CC=CC=C2C2=C1C8=CC=C2)C1=CC=CC2=CC=CC=C21)C1=CC=CC=C1

DOS

IR

Vibrations