Geometry & MOs

Info

ID:	1140
PubChem CID:	3845
Reduced:	NO3H7C10 (1)
Stoich.:	AB3C7D10 (1)
Weight, g/mol:	189.042593
ΔH_f, kcal/mol:	-78.94
Dipole, Da:	3.25
IP(EA), eV:	-9.35(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-oxo-1H-quinoline-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C=C(N2)C(=O)O

DOS

IR

Vibrations