Information card for entry 7117692

Structure parameters

• Formula: C94 H86 N2 Sn2
• Calculated formula: C94 H86 N2 Sn2
• Title of publication: A neutral low-coordinate heterocyclic bismuth-in species
• Authors of publication: C. Hering-Junghans; A. Schulz; A. Villinger
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 13834
• a: 10.3114 ± 0.0006 Å
• b: 12.6833 ± 0.0006 Å
• c: 14.8438 ± 0.0006 Å
• α: 101.757 ± 0.003°
• β: 90.344 ± 0.002°
• γ: 99.28 ± 0.003°
• Cell volume: 1874.19 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0623
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0974
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No