Geometry & MOs

Info

ID:	377859
PubChem CID:	134223924
Reduced:	ON3H13C21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	542.210661
ΔH_f, kcal/mol:	93.84
Dipole, Da:	11.71
IP(EA), eV:	-8.12(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenylmethoxyquinoline

Drug info:

PubChemData

Smile

C1=CC2=C(C3=C(C=C2)C=C/C(=C/4\C=CC(=O)C5=C4C=CC=N5)/N3)N=C1

DOS

IR

Vibrations