Information card for entry 4022839

Structure parameters

• Formula: C49.25 H66 B5 N5 O10
• Calculated formula: C49.26 H60 B5 N5 O10
• Title of publication: Multicomponent Assembly of Boron-Based Dendritic Nanostructures
• Authors of publication: Nicolas Christinat; Rosario Scopelliti; Kay Severin
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2007
• Journal volume: 72
• Pages of publication: 2192 - 2200
• a: 24.05 ± 0.005 Å
• b: 25.72 ± 0.003 Å
• c: 16.369 ± 0.004 Å
• α: 90°
• β: 90.566 ± 0.014°
• γ: 90°
• Cell volume: 10125 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1386
• Residual factor for significantly intense reflections: 0.0962
• Weighted residual factors for significantly intense reflections: 0.2435
• Weighted residual factors for all reflections included in the refinement: 0.291
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No