Information card for entry 2210976

Structure parameters

• Chemical name: Di-μ-iodo-bis[diiodobis(1,10-phenanthroline)bismuth(III)]
• Formula: C24 H16 Bi2 I6 N4
• Calculated formula: C24 H16 Bi2 I6 N4
• SMILES: [Bi]12([n]3cccc(c34)ccc3c4[n]1ccc3)(I)(I)[I][Bi]1([n]3cccc(c34)ccc3c4[n]1ccc3)(I)(I)[I]2
• Title of publication: Di-μ-iodo-bis[diiodo(1,10-phenanthroline)bismuth(III)]
• Authors of publication: Tershansy, Meredith A.; Goforth, Andrea M.; Smith, Mark D.; Peterson Jr, LeRoy; Loye, Hans-Conrad zur
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: m2987 - m2989
• a: 11.4058 ± 0.0006 Å
• b: 11.0804 ± 0.0006 Å
• c: 13.5775 ± 0.0007 Å
• α: 90°
• β: 105.674 ± 0.001°
• γ: 90°
• Cell volume: 1652.13 ± 0.15 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0188
• Residual factor for significantly intense reflections: 0.0181
• Weighted residual factors for significantly intense reflections: 0.0439
• Weighted residual factors for all reflections included in the refinement: 0.0442
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes