Geometry & MOs

Info

ID:	369956
PubChem CID:	127336947
Reduced:	SN2O5C19H28 (1)
Stoich.:	AB2C5D19E28 (1)
Weight, g/mol:	396.171893
ΔH_f, kcal/mol:	-216.12
Dipole, Da:	9.94
IP(EA), eV:	-9.07(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-[2-hydroxy-2-(oxan-4-yl)ethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NCC(C3CCOCC3)O

DOS

IR

Vibrations