Information card for entry 7130689

Structure parameters

• Formula: C50 H62 Mg N2 O Si
• Calculated formula: C50 H62 Mg N2 O Si
• SMILES: [Si]([Mg]1([O]=C(c2ccccc2)c2ccccc2)[N](=C(C)C=C(N1c1c(cccc1C(C)C)C(C)C)C)c1c(cccc1C(C)C)C(C)C)(C)(C)c1ccccc1
• Title of publication: Diverse reactivity of a magnesium silanide toward ketones
• Authors of publication: Okokhere-Edeghoghon, Bibian; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L.
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 9.833 ± 0.0003 Å
• b: 10.8375 ± 0.0004 Å
• c: 21.322 ± 0.0008 Å
• α: 95.428 ± 0.003°
• β: 92.237 ± 0.003°
• γ: 100.071 ± 0.003°
• Cell volume: 2223.56 ± 0.14 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 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: 0.059
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1054
• Weighted residual factors for all reflections included in the refinement: 0.1124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No