Geometry & MOs

Info

ID:	1515
PubChem CID:	4628
Reduced:	NO5H11C13 (1)
Stoich.:	AB5C11D13 (1)
Weight, g/mol:	261.063722
ΔH_f, kcal/mol:	-161.62
Dipole, Da:	10.71
IP(EA), eV:	-9.24(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-8-oxo-[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid

Drug info:

PubChemData

Smile

CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)O

DOS

IR

Vibrations