Geometry & MOs

Info

ID:	78960
PubChem CID:	49742862
Reduced:	N3O3H19C22 (1)
Stoich.:	A3B3C19D22 (1)
Weight, g/mol:	407.16452
ΔH_f, kcal/mol:	-59.25
Dipole, Da:	8.32
IP(EA), eV:	-8.88(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-5-oxo-N-(2-oxo-4-propan-2-yl-1H-quinolin-7-yl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=O)NC2=C1C=CC(=C2)NC(=O)C(=O)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations