Information card for entry 7720445

Structure parameters

• Formula: C47 H87 Ca N3 O2 Si2
• Calculated formula: C47 H87 Ca N3 O2 Si2
• Title of publication: Synthesis of heteroleptic calcium amide complexes <i>via</i> manipulation of the Schlenk equilibrium.
• Authors of publication: de Vere-Tucker, Matthew; Slawin, Alexandra M. Z.; Cordes, David B.; Stasch, Andreas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 4
• Pages of publication: 1708 - 1715
• a: 12.1402 ± 0.0014 Å
• b: 18.385 ± 0.003 Å
• c: 22.976 ± 0.003 Å
• α: 90°
• β: 92.196 ± 0.004°
• γ: 90°
• Cell volume: 5124.4 ± 1.2 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0407
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.0992
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No