Crystal structure of 3,5-di-methyl-pyridine N -oxide dihydrate.

Autor: Merino García R; Centro de Química, Instituto de Ciencias, Benemérita Universidad Autónoma de Puebla, 72570 Puebla, Pue., Mexico., Ríos-Merino FJ; Centro de Química, Instituto de Ciencias, Benemérita Universidad Autónoma de Puebla, 72570 Puebla, Pue., Mexico., Bernès S; Instituto de Física, Benemérita Universidad Autónoma de Puebla, Av. San Claudio y 18 Sur, 72570 Puebla, Pue., Mexico., Reyes-Ortega Y; Centro de Química, Instituto de Ciencias, Benemérita Universidad Autónoma de Puebla, 72570 Puebla, Pue., Mexico.
Jazyk: angličtina
Zdroj: Acta crystallographica. Section E, Crystallographic communications [Acta Crystallogr E Crystallogr Commun] 2016 Nov 01; Vol. 72 (Pt 12), pp. 1687-1690. Date of Electronic Publication: 2016 Nov 01 (Print Publication: 2016).
DOI: 10.1107/S205698901601687X
Abstrakt: In the title compound, also known as 3,5-lutidine N -oxide dihydrate, C 7 H 9 NO·2H 2 O, the N-O bond is weakened due to the involvement of the O atom as an acceptor of hydrogen bonds from the two water mol-ecules of crystallization present in the asymmetric unit. Fused R 3 5 (10) ring motifs based on O-H⋯O hydrogen bonds form chains in the [010] direction, which are further connected by weak C-H⋯O inter-molecular contacts. As a result, the lutidine mol-ecules are stacked in an efficient manner, with π-π contacts characterized by a short separation of 3.569 (1) Å between the benzene rings.
Databáze: MEDLINE