Information card for entry 8106023

Structure parameters

• Formula: C22 H20 Cl2 N2 O3 Sn
• Calculated formula: C22 H20 Cl2 N2 O3 Sn
• Title of publication: Crystal structure of catena-{di-aqua-sodium [n-butyl(methyl)carbamothioyl]sulfanide}n, [C6H16NNaO2S2]n
• Authors of publication: Lo, Kong Mun; Lee, See Mun; Zaldi, Nordiyana Binti; Hussen, Rusnah Syahila Duali; Tiekink, Edward R.T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 6
• Pages of publication: 1333 - 1335
• a: 8.1234 ± 0.0003 Å
• b: 10.7966 ± 0.0003 Å
• c: 24.9785 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2190.74 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0317
• Residual factor for significantly intense reflections: 0.0271
• Weighted residual factors for significantly intense reflections: 0.0624
• Weighted residual factors for all reflections included in the refinement: 0.0645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No