Geometry & MOs

Info

ID:

377667

PubChem CID:

134223731

Reduced:

ON4H38C59 (1)

Stoich.:

AB4C38D59 (1)

Weight, g/mol:

921.346761

ΔHf, kcal/mol:

238.62

Dipole, Da:

0.9

IP(EA), eV:

 -8.01(-1.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(C2=C(C=C(C=C2)C3=CC4=C(C=C3)N(C5=C4C=C6C7=CC=CC=C7OC6=C5)C8=NC9=CC=CC=C9C(=N8)C2=CC=CC=C2)C2=C1C=C1C(=C2)C2=CC=CC=C2N1C1=CC=CC=C1)C

DOS

IR

Vibrations