Geometry & MOs

Info

ID:	361072
PubChem CID:	127301962
Reduced:	SN3O3C20H31 (1)
Stoich.:	AB3C3D20E31 (1)
Weight, g/mol:	393.208613
ΔH_f, kcal/mol:	-126.56
Dipole, Da:	6.92
IP(EA), eV:	-8.98(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-[(1-ethylpiperidin-2-yl)methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1CCCCC1CNC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CCCC3

DOS

IR

Vibrations