Pienaar, Daniel P.; Khorasani, Sanaz; de Koning, Charles B.; Michael, Joseph P. published the artcile< 3-Hydroxy-1-(4-methoxybenzyl)piperidin-2-one>, Safety of (4aS,7R,8aS)-9,9-Dimethyltetrahydro-4H-4a,7-methanobenzo[c][1,2]oxazireno[2,3-b]isothiazole 3,3-dioxide, the main research area is mol structure hydroxy methoxybenzyl piperidinone; crystal structure hydroxy methoxybenzyl piperidinone; hydrogen bond hydroxymethoxybenzylpiperidinone.
The title compound, C13H17NO3, adopts a conformation in which the aromatic ring and the mean plane of the piperidine ring are almost perpendicular to each other [dihedral angle = 79.25(6)°]. The presence of the carbonyl group alters the conformation of the piperidine ring from a chair to a twisted half-chair conformation. In the crystal, pairs of strong O-H···O H bonds link the mols. into inversion dimers. Weak C-H···O interactions extend the H-bonding network into three dimensions. Crystallog. data and at. coordinates are given.
Acta Crystallographica, Section E: Structure Reports Online published new progress about Crystal structure. 104322-63-6 belongs to class isothiazole, and the molecular formula is C10H15NO3S, Safety of (4aS,7R,8aS)-9,9-Dimethyltetrahydro-4H-4a,7-methanobenzo[c][1,2]oxazireno[2,3-b]isothiazole 3,3-dioxide.
Referemce:
Isothiazole – Wikipedia,
Isothiazole – ScienceDirect.com