Geometry & MOs

Info

ID:

377483

PubChem CID:

134223538

Reduced:

NOH15C26 (2)

Stoich.:

ABC15D26 (2)

Weight, g/mol:

921.346761

ΔHf, kcal/mol:

174.4

Dipole, Da:

2.51

IP(EA), eV:

 -8.15(-0.81)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)-7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=CC=CC=C3C4=CC5=C(C=C42)OC6=C5C=C(C=C6)C7=CC8=C(C=C7)N(C9=C8C=C1C2=CC=CC=C2OC1=C9)C1=CC2=CC=CC=C2C=C1

DOS

IR

Vibrations