Geometry & MOs

Info

ID:

439625

PubChem CID:

135229411

Reduced:

ON2H32C51 (1)

Stoich.:

AB2C32D51 (1)

Weight, g/mol:

881.32938

ΔHf, kcal/mol:

197.19

Dipole, Da:

1.17

IP(EA), eV:

 -7.3(-0.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)spiro[2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene-13,9'-fluorene]-3'-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=CC=CC=C3N(C4=CC=CC=C42)C5=CC6=C(C=C5)C7=CC=CC=C7C68C9=C(C1=CC=CC=C1C=C9)OC1=C8C=CC2=CC=CC=C21

DOS

IR

Vibrations