Geometry & MOs

Info

ID:	363772
PubChem CID:	127313412
Reduced:	O3N4C22H30 (1)
Stoich.:	A3B4C22D30 (1)
Weight, g/mol:	384.216141
ΔH_f, kcal/mol:	-109.72
Dipole, Da:	7.37
IP(EA), eV:	-8.8(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C=CC(=C2)C(=O)NCCN3CCN(CC3)C(=O)C4CCC4

DOS

IR

Vibrations