Information card for entry 1568973

Structure parameters

• Formula: C29 H43 B Cl5 Ga N2 O2
• Calculated formula: C29 H43 B Cl5 Ga N2 O2
• Title of publication: Taming the parent oxoborane.
• Authors of publication: Kundu, Gargi; Amrutha, P. R.; Raj, K. Vipin; Tothadi, Srinu; Vanka, Kumar; Sen, Sakya S.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 22
• Pages of publication: 5894 - 5898
• a: 10.6403 ± 0.0013 Å
• b: 16.18 ± 0.002 Å
• c: 10.8244 ± 0.0012 Å
• α: 90°
• β: 111.793 ± 0.004°
• γ: 90°
• Cell volume: 1730.3 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0738
• Residual factor for significantly intense reflections: 0.0711
• Weighted residual factors for significantly intense reflections: 0.1884
• Weighted residual factors for all reflections included in the refinement: 0.1899
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No