Information card for entry 2228114

Structure parameters

• Chemical name: Tri-μ-sulfato-κ^6^<i>O</i>:<i>O</i>'-bis[aqua(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')indium(III)] dihydrate
• Formula: C24 H24 In2 N4 O16 S3
• Calculated formula: C24 H24 In2 N4 O16 S3
• SMILES: [In]123(OS(=O)(=O)O[In]4(OS(=O)(=O)O1)(OS(=O)(=O)O2)([OH2])[n]1cccc2c1c1[n]4cccc1cc2)([OH2])[n]1cccc2c1c1[n]3cccc1cc2.O.O
• Title of publication: Tri-μ-sulfato-κ^6^<i>O</i>:<i>O</i>'-bis[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')indium(III)] dihydrate
• Authors of publication: Shen, Fwu Ming; Lush, Shie Fu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 10
• Pages of publication: m1260 - m1261
• a: 10.5909 ± 0.0002 Å
• b: 12.0354 ± 0.0002 Å
• c: 13.3593 ± 0.0003 Å
• α: 79.904 ± 0.001°
• β: 79.606 ± 0.001°
• γ: 64.727 ± 0.001°
• Cell volume: 1505.32 ± 0.05 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.097
• Residual factor for significantly intense reflections: 0.0823
• Weighted residual factors for significantly intense reflections: 0.2169
• Weighted residual factors for all reflections included in the refinement: 0.2243
• Goodness-of-fit parameter for all reflections included in the refinement: 1.167
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes