Geometry & MOs

Info

ID:	3812
PubChem CID:	10243
Reduced:	NO2H7C10 (1)
Stoich.:	AB2C7D10 (1)
Weight, g/mol:	173.047678
ΔH_f, kcal/mol:	-29.57
Dipole, Da:	3.43
IP(EA), eV:	-9.95(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

quinoline-4-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations