Geometry & MOs

Info

ID:

377583

PubChem CID:

134223642

Reduced:

N2O2H38C67 (1)

Stoich.:

A2B2C38D67 (1)

Weight, g/mol:

904.308979

ΔHf, kcal/mol:

244.69

Dipole, Da:

2.41

IP(EA), eV:

 -8.04(-0.75)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-(9,9-diphenylfluoren-2-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)N(C6=C5C=C7C8=CC=CC=C8OC7=C6)C9=CC1=C(C=C9)C3=CC=CC=C3C11C3=CC=CC=C3C3=CC=CC=C13)C1=C2C=C2C(=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations