Information card for entry 2004199

Structure parameters

• Formula: C7 H13 N S2
• Calculated formula: C7 H13 N S2
• SMILES: S=C1SCC(N1)C(C)(C)C
• Title of publication: Six Substituted Thiazolidine-2-thiones
• Authors of publication: Laknifli, A.; Pierrot, M.; Chanon, F.; Chanon, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2661 - 2665
• a: 9.351 ± 0.003 Å
• b: 9.098 ± 0.003 Å
• c: 10.838 ± 0.003 Å
• α: 90°
• β: 81.54 ± 0.05°
• γ: 90°
• Cell volume: 912 ± 0.5 ų
• Cell temperature: 293 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0345
• Goodness-of-fit parameter for significantly intense reflections: 0.701
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No