Geometry & MOs

Info

ID:	344910
PubChem CID:	127268670
Reduced:	ClNS2O4C15H20 (1)
Stoich.:	ABC2D4E15F20 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-164.1
Dipole, Da:	7.0
IP(EA), eV:	-9.53(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methylpyridin-2-yl)-1-(oxan-2-ylmethylsulfonyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)S(=O)(=O)C2CCS(=O)(=O)CC2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations