Geometry & MOs

Info

ID:	46975
PubChem CID:	10528731
Reduced:	NO2H14C15 (2)
Stoich.:	AB2C14D15 (2)
Weight, g/mol:	480.204907
ΔH_f, kcal/mol:	-78.79
Dipole, Da:	2.54
IP(EA), eV:	-9.66(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[1-(1-ethyl-2-hydroxy-4-oxoquinolin-3-yl)-2-phenylethyl]-2-hydroxyquinolin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](CO)NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)N[C@H](CO)C4=CC=CC=C4

DOS

IR

Vibrations