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Two polymorphic forms of the oxathiin systemic fungicide active carboxine

Two polymorphic crystal forms of the title compound, C(12)H(13)NO(2)S (systematic name: 6-methyl-N-phenyl-2,3-di­hydro-1,4-oxathiine-5-carboxamide), were isolated from a truncated, (12 solvent), polymorph screen on pure lyophillized material. Crystals of form 1 were obtained from all solvents includ...

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Detalles Bibliográficos
Autores principales: Frampton, Christopher S., Frampton, Eleanor S., Thomson, Paul A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6281101/
https://www.ncbi.nlm.nih.gov/pubmed/30574366
http://dx.doi.org/10.1107/S2056989018015451
Descripción
Sumario:Two polymorphic crystal forms of the title compound, C(12)H(13)NO(2)S (systematic name: 6-methyl-N-phenyl-2,3-di­hydro-1,4-oxathiine-5-carboxamide), were isolated from a truncated, (12 solvent), polymorph screen on pure lyophillized material. Crystals of form 1 were obtained from all solvents included in the screen with the exception of methanol. As isolated from aceto­nitrile the crystals are triclinic, space group P [Image: see text] with Z′ = 2. Crystals of form 2, which were isolated from methanol only are monoclinic, space group I2/a with Z′ = 1. The crystal packing in both structures is dominated by the formation of infinite –NH⋯O hydrogen-bonded chains through the carboxamide core.