Information card for entry 4325006

Structure parameters

• Formula: C14 H32 B10 N2 O3
• Calculated formula: C14 H32 B10 N2 O3
• Title of publication: m-Carborane-Based Chiral NBN Pincer-Metal Complexes: Synthesis, Structure, and Application in Asymmetric Catalysis
• Authors of publication: Mohamed E. El-Zaria; Hidekazu Arii; Hiroyuki Nakamura
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 4149 - 4161
• a: 33.866 ± 0.014 Å
• b: 6.684 ± 0.003 Å
• c: 9.784 ± 0.004 Å
• α: 90°
• β: 92.669 ± 0.005°
• γ: 90°
• Cell volume: 2212.3 ± 1.6 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.063
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1472
• Weighted residual factors for all reflections included in the refinement: 0.1537
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No