Geometry & MOs

Info

ID:	69462
PubChem CID:	47183955
Reduced:	OSN3H13C14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	259.095691
ΔH_f, kcal/mol:	40.67
Dipole, Da:	4.18
IP(EA), eV:	-9.14(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(methylamino)-2-oxoethyl]-4-oxo-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CS1)NC(=O)C2=C3C=NNC3=CC=C2

DOS

IR

Vibrations