Geometry & MOs

Info

ID:	77252
PubChem CID:	48425977
Reduced:	BrN2O4C15H21 (1)
Stoich.:	AB2C4D15E21 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-147.83
Dipole, Da:	3.78
IP(EA), eV:	-8.56(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(C(=CC(=C1)OC)Br)OC

DOS

IR

Vibrations