Information card for entry 7130126

Structure parameters

• Formula: C83 H127 Ga2 N6 O2 Si2
• Calculated formula: C83 H127 Ga2 N6 O2 Si2
• Title of publication: Facile C–H Bond Activation on a Transient Gallium Imide
• Authors of publication: Kassymbek, Aishabibi; Spasyuk, Denis M.; Dmitrienko, Anton; Pilkington, Melanie; Nikonov, Georgii I.
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 11.94 ± 0.002 Å
• b: 17.146 ± 0.003 Å
• c: 20.083 ± 0.004 Å
• α: 90°
• β: 97.15 ± 0.03°
• γ: 90°
• Cell volume: 4079.5 ± 1.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0929
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.65254 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No