Geometry & MOs

Info

ID:	177412
PubChem CID:	76182892
Reduced:	O4C11H16 (1)
Stoich.:	A4B11C16 (1)
Weight, g/mol:	239.034921
ΔH_f, kcal/mol:	-169.08
Dipole, Da:	1.05
IP(EA), eV:	-9.93(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-ethoxy-4-hydroxy-4aH-quinolin-2-one

Drug info:

PubChemData

Smile

CC1(C=C(CCO1)C(=CC(=O)OC)O)C

DOS

IR

Vibrations