Geometry & MOs

Info

ID:

377480

PubChem CID:

134223535

Reduced:

ON2H30C45 (1)

Stoich.:

AB2C30D45 (1)

Weight, g/mol:

921.346761

ΔHf, kcal/mol:

143.51

Dipole, Da:

2.98

IP(EA), eV:

 -7.99(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=C(N4)C=CC(=C5)C6=CC7=C(C=C6)N(C8=C7C=C9C1=CC=CC=C1OC9=C8)C1=CC=CC=C1)C

DOS

IR

Vibrations