Geometry & MOs

Info

ID:

377475

PubChem CID:

134223530

Reduced:

NOH16C27 (2)

Stoich.:

ABC16D27 (2)

Weight, g/mol:

864.277678

ΔHf, kcal/mol:

181.5

Dipole, Da:

0.93

IP(EA), eV:

 -8.21(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[7-(3-fluoranthen-3-ylphenyl)-[1]benzofuro[2,3-b]carbazol-10-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)N3C4=C(C=C(C=C4)C5=CC6=C(C=C5)OC7=C6C=C8C9=CC=CC=C9N(C8=C7)C1=CC=CC=C1)C1=C3C=C2C(=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations