Geometry & MOs

Info

ID:	190396
PubChem CID:	77996515
Reduced:	ON5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	846.372247
ΔH_f, kcal/mol:	51.85
Dipole, Da:	3.73
IP(EA), eV:	-8.99(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[3-[9-[3-(4-phenyl-1,2-dihydro-1,10-phenanthrolin-2-yl)phenyl]fluoren-9-yl]phenyl]ethyl]-7-(1-phenylethylidene)quinolin-8-imine

Drug info:

PubChemData

Smile

C1CC(CCC1NC2=NC=NC3=C2C=NN3)OCC4CC4C5CC=CC=C5

DOS

IR

Vibrations