Geometry & MOs

Info

ID:	260069
PubChem CID:	103179760
Reduced:	SO2N3C12H25 (1)
Stoich.:	AB2C3D12E25 (1)
Weight, g/mol:	215.152144
ΔH_f, kcal/mol:	-79.51
Dipole, Da:	5.91
IP(EA), eV:	-8.57(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-methoxypropoxy)ethyl]piperidin-3-one

Drug info:

PubChemData

Smile

COCCCOCCN1CCN(CC1)CC(=S)N

DOS

IR

Vibrations