Geometry & MOs

Info

ID:	297051
PubChem CID:	117607151
Reduced:	BrClN2O5C28H36 (1)
Stoich.:	ABC2D5E28F36 (1)
Weight, g/mol:	945.346761
ΔH_f, kcal/mol:	-214.92
Dipole, Da:	8.57
IP(EA), eV:	-8.98(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[4-[4-[8-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]dibenzofuran-2-yl]phenyl]phenyl]carbazole

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)CN(CC2=CC(=C(C=C2OC)Cl)Br)C(=O)C3CCN(CC3)C(=O)OC(C)(C)C

DOS

IR

Vibrations