Information card for entry 7712398

Structure parameters

• Formula: C11.333 H10 N2 S1.333
• Calculated formula: C11.3333 H10 N2 S1.33333
• Title of publication: Free-Catalysed Synthesis of Thiazolidine-Thiourea Ligands for Metal Coordination (Au and Ag) and Preliminary Cytotoxic Studies
• Authors of publication: Salvador, Daniel; Herrera, Raquel; Gimeno, Maria Concepcion
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 5.6436 ± 0.0011 Å
• b: 11.4 ± 0.002 Å
• c: 12.26 ± 0.003 Å
• α: 101.37 ± 0.03°
• β: 90.7 ± 0.03°
• γ: 99.42 ± 0.03°
• Cell volume: 762.1 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0908
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0447
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No