Geometry & MOs

Info

ID:	244794
PubChem CID:	99381469
Reduced:	N4O4C19H22 (1)
Stoich.:	A4B4C19D22 (1)
Weight, g/mol:	370.164105
ΔH_f, kcal/mol:	-148.44
Dipole, Da:	1.97
IP(EA), eV:	-9.18(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2S)-2-(2-amino-2-oxoethyl)piperidin-1-yl]-2-oxoethyl]-4-oxo-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN([C@H](C1)CC(=O)N)C(=O)CNC(=O)C2=CNC3=CC=CC=C3C2=O

DOS

IR

Vibrations