The synthesis and crystal structures of 2-(4-fluoro-phen-yl)-3-phenyl-2,3-di-hydro-4H-pyrido[3,2-e][1,3]thia-zin-4-one toluene hemisolvate (1), C(19)H(13)FN(2)OS·0.5C(7)H(8), and 2-(4-nitro-phen-yl)-3-phenyl-2,3-di-hydro-4H-pyrido[3,2-e][1,3]thia-zin-4-one iso-propanol 0.25-solvate 0.0625-hydrate (2), C(19)H(13)N(3)O(3)S·0.25C(3)H(7)O·0.0625H(2)O, are reported. Both are racemic mixtures (centrosymmetric crystal structures) of the individual com-pounds and incorporate solvent mol-ecules in their structures. Compound 2 has four thia-zine mol-ecules in the asymmetric unit. All the thia-zine rings in this study show an envelope pucker, with the C atom bearing the substituted phenyl ring displaced from the other atoms. The phenyl and aryl rings in each of the mol-ecules are roughly orthogonal to each other, with dihedral angles of about 75°. The extended structures of 1 and 2 are consolidated by C-Hâ¯O and C-Hâ¯N(Ï), as well as T-type (C-Hâ¯Ï) inter-actions. Parallel aromatic ring inter-actions (Ï-Ï stacking) are observed only in 2.
Crystal structures of two solvated 2-aryl-3-phenyl-2,3-di-hydro-4H-pyrido[3,2-e][1,3]thia-zin-4-ones.
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作者:Yennawar Hemant P, Thompson Eric N, Li Jennie, Silverberg Lee J
| 期刊: | Acta Crystallographica Section E: Crystallographic Communications | 影响因子: | 0.500 |
| 时间: | 2019 | 起止号: | 2019 Oct 22; 75(Pt 11):1689-1693 |
| doi: | 10.1107/S2056989019013781 | ||
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