Geometry & MOs

Info

ID:

445985

PubChem CID:

135271107

Reduced:

NOH43C68 (1)

Stoich.:

ABC43D68 (1)

Weight, g/mol:

731.264671

ΔHf, kcal/mol:

270.27

Dipole, Da:

1.82

IP(EA), eV:

 -8.3(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(9,9'-spirobi[fluorene]-4-yl)-N-spiro[cyclopentane-1,9'-fluorene]-2'-yldibenzothiophen-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C(C=CC=C42)C5=CC=C(C=C5)N(C6=C7C8=CC=CC=C8OC7=CC=C6)C9=CC=CC1=C9C2=CC=CC=C2C11C2=CC=CC=C2C2=CC=CC=C12)C1=CC=CC=C1

DOS

IR

Vibrations