Geometry & MOs

Info

ID:	377989
PubChem CID:	134224056
Reduced:	ON3H19C29 (1)
Stoich.:	AB3C19D29 (1)
Weight, g/mol:	452.163711
ΔH_f, kcal/mol:	116.87
Dipole, Da:	2.57
IP(EA), eV:	-8.15(-1.12)
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]quinolin-8-ol

Drug info:

PubChemData

Smile

C1=C/C(=C/2\C=CC=C(N2)C3=CC=CC(=C3)C4=NC5=C(C=CC6=C5N=CC=C6)C=C4)/C(=O)C=C1

DOS

IR

Vibrations