Geometry & MOs

Info

ID:	169805
PubChem CID:	75152234
Reduced:	O2C9H9 (2)
Stoich.:	A2B9C9 (2)
Weight, g/mol:	940.370194
ΔH_f, kcal/mol:	-123.13
Dipole, Da:	2.16
IP(EA), eV:	-9.49(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-amino-5-methylpiperidin-1-yl)-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid;oxalic acid;hydrate

Drug info:

PubChemData

Smile

CC(=O)C(CC1=CC=CC=C1)(C(=O)OCC2=CC=CC=C2)O

DOS

IR

Vibrations