Geometry & MOs

Info

ID:	313055
PubChem CID:	126611104
Reduced:	F3O3N4C19H23 (1)
Stoich.:	A3B3C4D19E23 (1)
Weight, g/mol:	797.340613
ΔH_f, kcal/mol:	-234.49
Dipole, Da:	8.54
IP(EA), eV:	-9.23(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[6-(9-cyclohexyl-9-phenylfluoren-2-yl)dibenzofuran-4-yl]phenyl]-4,6-diphenyl-1,3,5-triazine

Drug info:

PubChemData

Smile

C[C@@H]1N(C[C@H](O1)C(=O)N2CCN(CC2)CCO)C3=CC(=C(C=C3)C#N)C(F)(F)F

DOS

IR

Vibrations