Geometry & MOs

Info

ID:	77087
PubChem CID:	48425788
Reduced:	ClN2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	347.187878
ΔH_f, kcal/mol:	-134.05
Dipole, Da:	5.93
IP(EA), eV:	-9.22(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-1-propylsulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCOC1=CC(=CC=C1)Cl

DOS

IR

Vibrations