Information card for entry 4321433

Structure parameters

• Formula: C72 H108 Co2 N3 Na3 O18 S6
• Calculated formula: C77.191 H108 Co2 N3.65 Na3 O18 S6
• Title of publication: Unprecedented Stabilization of Cobalt(II) in a Tetrahedral S2O2 Environment: The Use of a Redox-Noninnocent Ligand
• Authors of publication: Núria Duran; William Clegg; Lourdes Cucurull-Sánchez; Robert A. Coxall; Hermas R. Jiménez; José-María Moratal; Francesc Lloret; Pilar González-Duarte
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 4821 - 4832
• a: 16.3925 ± 0.0013 Å
• b: 16.3925 ± 0.0013 Å
• c: 58.502 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 13614.2 ± 1.9 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 7
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0861
• Residual factor for significantly intense reflections: 0.0548
• Weighted residual factors for all reflections: 0.1573
• Weighted residual factors for significantly intense reflections: 0.1278
• Goodness-of-fit parameter for all reflections: 1.173
• Goodness-of-fit parameter for significantly intense reflections: 1.152
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No