Geometry & MOs

Info

ID:	12344
PubChem CID:	135473
Reduced:	INO2H6C10 (1)
Stoich.:	ABC2D6E10 (1)
Weight, g/mol:	298.94433
ΔH_f, kcal/mol:	-15.72
Dipole, Da:	7.85
IP(EA), eV:	-9.86(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-iodoquinoline-8-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=CC(=CC(=C2N=C1)C(=O)O)I

DOS

IR

Vibrations