Geometry & MOs

Info

ID:	79016
PubChem CID:	49743121
Reduced:	N3O4C23H23 (1)
Stoich.:	A3B4C23D23 (1)
Weight, g/mol:	403.189592
ΔH_f, kcal/mol:	-128.78
Dipole, Da:	2.24
IP(EA), eV:	-8.84(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethylphenyl)-N-(4-ethyl-2-oxo-1H-quinolin-7-yl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC(=O)NC2=C1C=CC(=C2)NC(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)OC

DOS

IR

Vibrations