Information card for entry 4022840

Structure parameters

• Formula: C94.5 H73 B5 Cl6 N10 O10
• Calculated formula: C94.5 H73.01 B5 Cl6 N10 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: 15.9647 ± 0.0019 Å
• b: 16.2747 ± 0.0018 Å
• c: 19.192 ± 0.002 Å
• α: 112.104 ± 0.008°
• β: 101.901 ± 0.009°
• γ: 94.52 ± 0.009°
• Cell volume: 4452.9 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1972
• Residual factor for significantly intense reflections: 0.1268
• Weighted residual factors for significantly intense reflections: 0.3497
• Weighted residual factors for all reflections included in the refinement: 0.4102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.556
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No