Information card for entry 4315577

Structure parameters

• Formula: C62 H24 Cl0 In10 N15 Na0 Ni3 O5 S19
• Calculated formula: C62 H24 In10 N15 Ni3 O5 S19
• Title of publication: Indium-Sulfur Supertetrahedral Clusters Integrated with a Metal Complex of 1,10-Phenanthroline
• Authors of publication: Zhi-Xin Lei; Qin-Yu Zhu; Xu Zhang; Wen Luo; Wen-Qin Mu; Jie Dai
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 4385 - 4387
• a: 11.8718 ± 0.0013 Å
• b: 16.1979 ± 0.0017 Å
• c: 29.047 ± 0.003 Å
• α: 81.602 ± 0.003°
• β: 86.877 ± 0.004°
• γ: 80.291 ± 0.003°
• Cell volume: 5444.1 ± 1 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.117
• Residual factor for significantly intense reflections: 0.093
• Weighted residual factors for significantly intense reflections: 0.1676
• Weighted residual factors for all reflections included in the refinement: 0.1788
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No