Geometry & MOs

Info

ID:	311417
PubChem CID:	126592242
Reduced:	FN3O3C24H32 (1)
Stoich.:	AB3C3D24E32 (1)
Weight, g/mol:	845.315461
ΔH_f, kcal/mol:	-149.13
Dipole, Da:	3.71
IP(EA), eV:	-8.68(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CC(N1C2CC3(CC1CC(C2)(C3)O)C)O)C4=CNC5=NC=C(C(=C45)F)OC6CC6

DOS

IR

Vibrations