Geometry & MOs

Info

ID:	310270
PubChem CID:	126577741
Reduced:	N2O2H20C37 (1)
Stoich.:	A2B2C20D37 (1)
Weight, g/mol:	549.147727
ΔH_f, kcal/mol:	140.13
Dipole, Da:	4.34
IP(EA), eV:	-8.43(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[2-([1]benzofuro[3,2-a]carbazol-12-yl)-5-cyanophenyl]dibenzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(N2C4=C(C=CC(=C4)C#N)C5=CC6=C(C=C5)OC7=CC=CC=C76)C8=C(C=C3)C9=CC=CC=C9O8

DOS

IR

Vibrations