Geometry & MOs

Info

ID:

310348

PubChem CID:

126579126

Reduced:

N3H35C55 (1)

Stoich.:

A3B35C55 (1)

Weight, g/mol:

637.251798

ΔHf, kcal/mol:

259.84

Dipole, Da:

3.21

IP(EA), eV:

 -8.68(-1.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-phenyl-2-[9-(2-phenyl-6-pyridin-4-ylpyridin-4-yl)-9H-fluoren-3-yl]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=NC(=C2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC(=C5)C6=CC(=CC=C6)C7=CC8=C(C=C7)C9=CC=CC=C9C1=CC=CC=C18)C1=CC=CC=C1

DOS

IR

Vibrations