16 research outputs found

    2-(3-Benzoyl-4-hy­droxy-1,1-dioxo-2H-1λ6,2-benzothia­zin-2-yl)-1-phenyl­ethanone

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    In the title mol­ecule, C23H17NO5S, the heterocyclic thia­zine ring adopts a half-chair conformation, with the S and N atoms displaced by 0.383 (3) and 0.473 (3) Å, respectively, on opposite sides of the mean plane formed by the ring C atoms. The phenyl rings attached to carbonyl groups lie almost parallel to each other at a dihedral angle 7.43 (9)°, the distance between the centroids of the rings being 3.780 (1) Å. The C(thia­zine)—C=O and O=C—CH2 groups make dihedral angles of 37.56 (16) and 1.93 (18)°, respectively, with the phenyl groups to which they are attached. The crystal structure features O—H⋯O and C—H⋯O hydrogen bonds and further consolidated by C—H⋯π inter­actions; an intra­molecular O—H⋯O hydrogen bond is also present

    (2-Chloro­phen­yl)(4-hy­droxy-1,1-dioxo-2H-1,2-benzothia­zin-3-yl)methanone

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    In the title mol­ecule, C15H10ClNO4S, the heterocyclic thia­zine ring adopts a half-chair conformation, with the S and N atoms displaced by 0.527 (7) and 0.216 (7) Å, respectively, on opposite sides of the mean plane formed by the remaining ring atoms. The mol­ecular structure is consolidated by an intra­molecular O—H⋯O inter­action and the crystal packing is stabilized by N—H⋯O and C—H⋯O hydrogen bonds

    3-[(3-Benzoyl-4-hy­droxy-1,1-dioxo-2H-1λ6,2-benzothia­zin-2-yl)meth­yl]benzo­nitrile

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    There are two independent mol­ecules in the asymmetric unit of the title compound, C23H17N2O4S, with significant differences in their conformations, e.g. the benzene rings of the benzothia­zine and benzonitrile units are inclined at 28.19 (10) and 17.89 (7)° in the two mol­ecules, with the centroids of the rings separated by 3.975 (2) and 3.637 (2) Å, respectively. Moreover, the N—C—C—C torsion angles involving the benzoyl group are 14.3 (5) and 8.2 (5)° in the two mol­ecules, showing different degrees of rotation of this group. In both mol­ecules, the heterocyclic thia­zine rings adopt half-chair conformations, with the S and N atoms displaced by 0.427 (6) and 0.365 (6) Å, respectively, in one mol­ecule and by 0.356 (6) and 0.432 (6) Å, respectively, in the other, on opposite sides of the mean planes formed by the remaining ring atoms. The crystal structure is stabilized by inter­molecular C—H⋯O hydrogen bonds and further consolidated by intra­molecular O—H⋯O hydrogen bonds

    (2-Bromo­phen­yl)(4-hy­droxy-1,1-dioxo-2H-1,2-benzothia­zin-3-yl)methanone

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    In the title mol­ecule, C15H10BrNO4S, the heterocyclic thia­zine ring adopts a half-chair conformation, with the S and N atoms displaced by 0.554 (7) and 0.198 (8) Å, respectively, on opposite sides of the mean plane formed by the remaining ring atoms. The mol­ecular structure is consolidated by intra­molecular O—H⋯O inter­actions and the crystal packing features N—H⋯O and C—H⋯O hydrogen bonds

    Assessment of Groundwater Quality of Taluka Bulri Shah Karim, District Tando Muhammad Khan, Sindh, Pakistan: Assessment of Groundwater Quality of Taluka Bulri Shah Karim, District Tando Muhammad Khan, Sindh, Pakistan

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    Groundwater in Pakistan is the main drinking water source, highlighting the significance of regularlymonitoring its quality. There have been several examples of high concentrations of elements like arsenic and nitrate ingroundwater that harm human health and the environment. Our aim with this study was to assess the groundwater qualityof the sub-district Bhulri Shah Karim for drinking and irrigation purposes. We collected groundwater samples from 53shallow bore well hand pumps in October and November 2018. We determined the concentration of four cations, fiveanions and other parameters like pH, turbidity, TDS, total hardness, EC, alkalinity, total iron, and arsenic. Thegroundwater was found to be very hard, and the relative abundance of cations and anions was Na+> Ca2+> Mg2+> K+ andCl‾ > HCO3‾ > SO42‾ > NO3‾ > F‾. The concentrations of arsenic and iron varied from 0 to 0.2 mg/L and 0.02 to 3.6mg/L, respectively. We discussed groundwater quality for drinking and irrigation purposes by calculating the waterquality index, sodium adsorption ratio, percent of sodium, permeability index, and residual sodium carbonate. Inconclusion, the groundwater of the studied area is suitable for drinking on average and irrigation. However, some watersamples were high in arsenic content, and some were highly saline and may need some prior treatmen

    2-[2-(2-Chlorophenyl)-2-oxoethyl]-2,3-dihydro-1λ6,2-benzothiazole-1,1,3-trione

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    The asymmetric unit of the title compound, C15H10ClNO4S, contains two independent conformers wherein the 2-chlorophenyl group in one is rotated by approximately 180° compared to the other molecule. This affects the S—N—C—C(=O) and N—C—C(=O)—C torsion angles giving vlaues of −87.0 (2) and 158.7 (2)° in one molecule and −104.3 (2) and −173.4 (2)° in the other. The benzisothiazole ring systems in the two molecules are essentially planar (r.m.s. deviations = 0.017 and 0.010 Å) and form dihedral angles of 73.53 (7) and 73.26 (6)° with the benzene rings. In the crystal, there are weak π–π interactions between the benzene rings of the benzisothiazole groups and symmetry-related chlorobenzene rings with centroid–centroid distances of 3.6178 (13) and 3.6267 (15) Å. In addition, pairs of weak intermolecular C—H...O hydrogen bonds form inversion dimers which are connected by further C—H...O hydrogen bonds into a three-dimensional network

    [2-(2,5-Dichlorobenzyl)-4-hydroxy-1,1-dioxo-2H-1,2-benzothiazin-3-yl](phenyl)methanone

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    In the title molecule, C22H15Cl2NO4S, the heterocyclic thiazine ring adopts a half-chair conformation, with the S and N atoms displaced by 0.343 (5) and 0.402 (5) Å, respectively, on opposite sides of the mean plane formed by the remaining ring atoms. The molecular structure is consolidated by an intramolecular O—H...O hydrogen bond, which generates an S(?) ring. In the crystal, the molecules are linked by C—H...O interactions into [010] chains

    2-[2-(2-Bromophenyl)-2-oxoethyl]-1λ6,2-benzothiazole-1,1,3-trione

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    The asymmetric unit of the title compound, C15H10BrNO4S, contains two different conformers in which the benzisothiazole rings are essentially planar, with r.m.s. deviations of 0.012 and 0.017 Å. The mean planes of the benzene rings form dihedral angles 70.49 (13) and 72.79 (11)° with the benzisothiazole rings. The orientation of the Br atoms in the two conformers exhibit the most pronounced difference, with opposing orientations in the two molecules. The crystal structure is stabilized by π–π interactions between the benzene rings of the benzisothiazole moieties of one molecule and bromobenzene rings of the other molecule, with distances between the ring centroids of 3.599 (3) and 3.620 (3) Å, respectively. The crystal packing is further consolidated by pairs of weak intermolecular C—H...O hydrogen bonds, which form inversion dimers

    2-[2-(2-Bromophenyl)-2-oxoethyl]-1λ 6

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