Geometry & MOs

Info

ID:

428780

PubChem CID:

135168159

Reduced:

NH22C35 (2)

Stoich.:

AB22C35 (2)

Weight, g/mol:

1028.376664

ΔHf, kcal/mol:

314.56

Dipole, Da:

1.08

IP(EA), eV:

 -8.04(-0.81)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzofuran-1-ylphenyl)-N-(7,7-diphenylbenzo[g]fluoren-9-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]-4'-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=C(C4=C2C=C(C=C4)N(C5=CC=CC6=CC=CC=C65)C7=CC=CC8=C7C9=CC=CC=C9C81C2=CC=CC=C2N2C4=CC=CC=C4C4=C2C1=CC=C4)C1=CC=CC=C1C=C3)C1=CC=CC=C1

DOS

IR

Vibrations