Geometry & MOs

Info

ID:

377555

PubChem CID:

134223613

Reduced:

OSN2H28C48 (1)

Stoich.:

ABC2D28E48 (1)

Weight, g/mol:

788.246378

ΔHf, kcal/mol:

188.38

Dipole, Da:

1.53

IP(EA), eV:

 -8.15(-0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC5=C(C=C4)C6=C(N5C7=CC=CC=C7)C=C8C(=C6)C9=CC=CC=C9S8)C1=C2C=C2C(=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations