Information card for entry 7122898

Structure parameters

• Common name: 1B
• Formula: C10 H34 B21 N
• Calculated formula: C10 H34 B21 N
• Title of publication: Synthesis of 9-Borafluorene Analogues Featuring a Three-Dimensional 1,1’-Bis(o-carborane) Backbone
• Authors of publication: Yruegas, Sam; Axtell, Jonathan; Kirlikovali, Kent; Spokoyny, Alex; Martin, Caleb Daniel
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.5847 ± 0.0011 Å
• b: 10.7181 ± 0.0011 Å
• c: 12.7511 ± 0.0013 Å
• α: 93.57 ± 0.006°
• β: 109.312 ± 0.005°
• γ: 116.93 ± 0.006°
• Cell volume: 1177.9 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0986
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1399
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No