Geometry & MOs

Info

ID:	55746
PubChem CID:	17396338
Reduced:	SN2O4H16C18 (1)
Stoich.:	AB2C4D16E18 (1)
Weight, g/mol:	354.121572
ΔH_f, kcal/mol:	-97.15
Dipole, Da:	3.92
IP(EA), eV:	-8.77(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-methoxyanilino)-2-oxoethyl] 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC3=CC=CC=C3C=C2OC

DOS

IR

Vibrations