Geometry & MOs

Info

ID:	78989
PubChem CID:	49743000
Reduced:	NOC11H13 (2)
Stoich.:	ABC11D13 (2)
Weight, g/mol:	288.111007
ΔH_f, kcal/mol:	-98.81
Dipole, Da:	5.87
IP(EA), eV:	-8.78(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(4-ethyl-2-oxo-1H-quinolin-7-yl)amino]-2-oxoacetate

Drug info:

PubChemData

Smile

CCC1=CC(=O)NC2=C1C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations