Geometry & MOs

Info

ID:

428933

PubChem CID:

135168449

Reduced:

NH21C34 (2)

Stoich.:

AB21C34 (2)

Weight, g/mol:

978.361014

ΔHf, kcal/mol:

307.35

Dipole, Da:

0.88

IP(EA), eV:

 -7.71(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-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]-10-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC=CC4=C3C5=CC=CC=C5C46C7=CC=CC=C7C8=CC=CC=C68)C9=CC1=C2C(=C9)C3(C4=CC=CC=C4C4=CC=CC=C43)C3=CC=CC=C3N2C2=CC=CC=C21

DOS

IR

Vibrations