Geometry & MOs

Info

ID:	357221
PubChem CID:	127293725
Reduced:	SO2N3C19H27 (1)
Stoich.:	AB2C3D19E27 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-83.24
Dipole, Da:	2.33
IP(EA), eV:	-8.43(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpiperidin-3-yl)-7,7-dimethyl-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NC(=O)CCC(=O)N2CCSC3=CC=CC=C32

DOS

IR

Vibrations