Geometry & MOs

Info

ID:	146220
PubChem CID:	53653267
Reduced:	NH7C11 (2)
Stoich.:	AB7C11 (2)
Weight, g/mol:	618.294116
ΔH_f, kcal/mol:	135.74
Dipole, Da:	3.74
IP(EA), eV:	-9.01(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[3-(2-carboxy-4-hexoxyquinolin-8-yl)oxypropoxy]-4-hexoxyquinoline-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C=C(C#N)C4=CC=NC=C4

DOS

IR

Vibrations