Geometry & MOs

Info

ID:	28971
PubChem CID:	830919
Reduced:	BrN2O2H9C16 (1)
Stoich.:	AB2C2D9E16 (1)
Weight, g/mol:	324.111007
ΔH_f, kcal/mol:	12.04
Dipole, Da:	5.59
IP(EA), eV:	-9.13(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-2-hydroxy-4-oxo-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C(=O)N2)N=C(O3)C4=CC=C(C=C4)Br

DOS

IR

Vibrations