Geometry & MOs

Info

ID:

377356

PubChem CID:

134223405

Reduced:

NOH16C27 (2)

Stoich.:

ABC16D27 (2)

Weight, g/mol:

764.196074

ΔHf, kcal/mol:

180.84

Dipole, Da:

1.66

IP(EA), eV:

 -8.18(-0.68)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[10-[7-(3,4-dicyanophenyl)-[1]benzofuro[2,3-b]carbazol-10-yl]-[1]benzofuro[2,3-b]carbazol-7-yl]benzene-1,2-dicarbonitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC=C(C=C4)C5=CC6=C(C=C5)OC7=C6C=C8C9=CC=CC=C9N(C8=C7)C1=CC=CC=C1)C1=C2C=C2C(=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations