Geometry & MOs

Info

ID:	177335
PubChem CID:	76168947
Reduced:	NO6C25H35 (1)
Stoich.:	AB6C25D35 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-227.18
Dipole, Da:	4.4
IP(EA), eV:	-8.59(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-2-oxo-N-(2-piperidin-1-ylethyl)-4aH-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC=CC=CC=CC=CC=CC(=CC(=O)N(C)C(CCC(=O)OC(C)(C)C)C(=O)OC)O

DOS

IR

Vibrations