Information card for entry 7709107

Structure parameters

• Formula: C50 H68 Mg2 N6 Si2
• Calculated formula: C50 H68 Mg2 N6 Si2
• Title of publication: Reduction of tert-butylphosphaalkyne and trimethylsilylnitrile with magnesium(I) dimers
• Authors of publication: Wilson, Daniel; Jones, Dafydd; Smith, Cory; Mehta, Meera; Jones, Cameron; Goicoechea, Jose M.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 10.7347 ± 0.0011 Å
• b: 11.2562 ± 0.001 Å
• c: 12.2531 ± 0.0012 Å
• α: 73.388 ± 0.009°
• β: 81.48 ± 0.009°
• γ: 64.513 ± 0.01°
• Cell volume: 1280.2 ± 0.2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0602
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1006
• Weighted residual factors for all reflections included in the refinement: 0.1102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No