Geometry & MOs

Info

ID:

439987

PubChem CID:

135229858

Reduced:

ON2H40C63 (1)

Stoich.:

AB2C40D63 (1)

Weight, g/mol:

929.32938

ΔHf, kcal/mol:

241.79

Dipole, Da:

2.2

IP(EA), eV:

 -7.74(-0.63)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-dibenzofuran-2-yl-N-(9,9-diphenylfluoren-3-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]-4'-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC4=C(C=C3)N(C5=CC=CC=C54)C6=CC=CC=C6)C7=CC8=C(C=C7)C9=CC=CC=C9C81C2=C(C3=CC=CC=C3C=C2)OC2=C1C=CC1=CC=CC=C12

DOS

IR

Vibrations