Information card for entry 7248588

Structure parameters

• Chemical name: 1-(4-methylthiazol-2-yl)piperidine-2,6-dione
• Formula: C9 H10 N2 O2 S
• Calculated formula: C9 H10 N2 O2 S
• Title of publication: A simple and efficient synthesis of a series of N -(thiazol-2-yl)piperidine-2,6-dione compounds and their interesting NLO properties
• Authors of publication: Shaiwale, Mayuri; Narayan, Som; Jha, Prafulla K.; Ballabh, Amar
• Journal of publication: CrystEngComm
• Year of publication: 2024
• a: 10.4402 ± 0.0013 Å
• b: 9.0667 ± 0.0012 Å
• c: 10.6841 ± 0.0015 Å
• α: 90°
• β: 103.828 ± 0.012°
• γ: 90°
• Cell volume: 982 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0523
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No