Information card for entry 2014859

Structure parameters

• Chemical name: mer-Triiodotripyridineindium(III)
• Formula: C15 H15 I3 In N3
• Calculated formula: C15 H15 I3 In N3
• SMILES: c1cccc[n]1[In](I)(I)([n]1ccccc1)(I)[n]1ccccc1
• Title of publication: <i>mer</i>-Triiodotripyridineindium(III)
• Authors of publication: Pardoe, Jennifer A. J.; Cowley, Andrew R.; Downs, Anthony J.; Greene, Timothy M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 4
• Pages of publication: m200 - m202
• a: 9.6622 ± 0.0002 Å
• b: 14.9139 ± 0.0004 Å
• c: 13.985 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2015.25 ± 0.09 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0409
• Residual factor for significantly intense reflections: 0.0248
• Weighted residual factors for all reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.0285
• Weighted residual factors for all reflections included in the refinement: 0.0285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No