Geometry & MOs

Info

ID:

317056

PubChem CID:

126632357

Reduced:

N5H85C107 (1)

Stoich.:

A5B85C107 (1)

Weight, g/mol:

1439.391864

ΔHf, kcal/mol:

370.87

Dipole, Da:

1.99

IP(EA), eV:

 -8.02(-1.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-dibenzothiophen-2-yl-9-[4-(3-dibenzothiophen-2-ylcarbazol-9-yl)-6-[7-(3-dibenzothiophen-2-ylcarbazol-9-yl)-9,9-diphenylfluoren-2-yl]-1,3,5-triazin-2-yl]carbazole

Drug info:

PubChemData

Smile

CC1(C2CCCCC2C3=C1C=CC(=C3)C4=CC5=C(C=C4)N(C6=CC=CC=C65)C7=CC8=C9C(=C7)C(C1=CC(=CC(=C19)C8(C)C)C1=NC(=NC2=C1C=C(C=C2)N1C2=C(C=C(C=C2)C2=CC3=C(C=C2)C(C2=CC=CC=C23)(C)C)C2=CC=CC=C21)N1C2=C(C=C(C=C2)C2=CC3=C(C=C2)C(C2=CC=CC=C23)(C)C)C2=CC=CC=C21)(C)C)C

DOS

IR

Vibrations