Geometry & MOs

Info

ID:

315835

PubChem CID:

126628991

Reduced:

OSN4H34C54 (1)

Stoich.:

ABC4D34E54 (1)

Weight, g/mol:

920.351512

ΔHf, kcal/mol:

230.42

Dipole, Da:

2.03

IP(EA), eV:

 -8.06(-1.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[6-[4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=CC=CC=C5N4C6=CC7=C(C=C6)OC8=C7C=CC=C8C9=NC(=NC(=N9)C1=CC=CC=C1)C1=CC=CC2=C1SC1=CC=CC=C21)C

DOS

IR

Vibrations