Geometry & MOs

Info

ID:	264854
PubChem CID:	103498314
Reduced:	SN2O2C16H26 (1)
Stoich.:	AB2C2D16E26 (1)
Weight, g/mol:	248.155849
ΔH_f, kcal/mol:	-81.55
Dipole, Da:	5.46
IP(EA), eV:	-9.34(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-(4-propan-2-ylpiperidin-1-yl)sulfonylethanamine

Drug info:

PubChemData

Smile

CC(C)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC

DOS

IR

Vibrations