Geometry & MOs

Info

ID:	214339
PubChem CID:	84975212
Reduced:	SN2O3C19H22 (1)
Stoich.:	AB2C3D19E22 (1)
Weight, g/mol:	292.166117
ΔH_f, kcal/mol:	-73.07
Dipole, Da:	2.11
IP(EA), eV:	-8.86(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[2-(4-methoxyanilino)-2-oxoethyl]piperidin-1-ium-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NC(C)C3CC3

DOS

IR

Vibrations