Information card for entry 4346234

Structure parameters

• Formula: C24 H60 Mn4 P4 Te4
• Calculated formula: C24 H60 Mn4 P4 Te4
• SMILES: [Te]12[Mn]34([P](CC)(CC)CC)[Mn]51([P](CC)(CC)CC)[Te]1[Mn]2([P](CC)(CC)CC)[Te]3[Mn]1([P](CC)(CC)CC)[Te]45
• Title of publication: Ligand Control of Manganese Telluride Molecular Cluster Core Nuclearity.
• Authors of publication: Choi, Bonnie; Paley, Daniel W.; Siegrist, Theo; Steigerwald, Michael L.; Roy, Xavier
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 17
• Pages of publication: 8348 - 8355
• a: 13.17415 ± 0.00005 Å
• b: 13.17415 ± 0.00005 Å
• c: 13.17415 ± 0.00005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2286.48 ± 0.015 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 197
• Hermann-Mauguin space group symbol: I 2 3
• Hall space group symbol: I 2 2 3
• Residual factor for all reflections: 0.0125
• Residual factor for significantly intense reflections: 0.0118
• Weighted residual factors for significantly intense reflections: 0.0284
• Weighted residual factors for all reflections included in the refinement: 0.0286
• Goodness-of-fit parameter for all reflections included in the refinement: 1.194
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No