Geometry & MOs

Info

ID:	273814
PubChem CID:	103805183
Reduced:	SN2O3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	281.116427
ΔH_f, kcal/mol:	-127.22
Dipole, Da:	6.44
IP(EA), eV:	-8.18(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminophenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

Drug info:

PubChemData

Smile

CCCCCS(=O)(=O)CC(=O)NC1=CC=CC=C1N

DOS

IR

Vibrations