Geometry & MOs

Info

ID:	354752
PubChem CID:	127287512
Reduced:	SO3N4C18H30 (1)
Stoich.:	AB3C4D18E30 (1)
Weight, g/mol:	389.140927
ΔH_f, kcal/mol:	-116.39
Dipole, Da:	6.69
IP(EA), eV:	-8.69(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-3-piperidin-1-ylsulfonylpyridin-2-amine

Drug info:

PubChemData

Smile

CC(C)(CNC1=C(C=CC=N1)S(=O)(=O)N2CCCCC2)N3CCOCC3

DOS

IR

Vibrations