Geometry & MOs

Info

ID:

439833

PubChem CID:

135229676

Reduced:

NO2H51C82 (1)

Stoich.:

AB2C51D82 (1)

Weight, g/mol:

1169.459666

ΔHf, kcal/mol:

284.52

Dipole, Da:

1.41

IP(EA), eV:

 -8.02(-0.74)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[4-[(9,9-diphenylfluoren-2-yl)-(9,9'-spirobi[fluorene]-3-yl)amino]phenyl]-9-(1-methylnaphthalen-2-yl)fluoren-9-yl]naphthalen-1-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C2C=C(C=C4)N(C5=CC=C(C=C5)C6=CC7=C(C=C6)C8=CC=CC=C8O7)C9=CC=C(C=C9)C1=C2C3=CC=CC=C3C3(C2=CC=C1)C1=C(C2=CC=CC=C2C=C1)OC1=C3C=CC2=CC=CC=C21)C1=CC=CC=C1

DOS

IR

Vibrations