Information card for entry 7049364

Structure parameters

• Formula: C59 H83 Ca Li N4 O2
• Calculated formula: C59 H83 Ca Li N4 O2
• Title of publication: Heterobimetallic Ba/Li and Ca/Li amides and diphenylmethanide.
• Authors of publication: le Coz, Erwann; Roueindeji, Hanieh; Dorcet, Vincent; Roisnel, Thierry; Carpentier, Jean-François; Sarazin, Yann
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 17
• Pages of publication: 5500 - 5504
• a: 13.991 ± 0.002 Å
• b: 25.818 ± 0.003 Å
• c: 15.859 ± 0.002 Å
• α: 90°
• β: 103.45 ± 0.005°
• γ: 90°
• Cell volume: 5571.5 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0754
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1583
• Weighted residual factors for all reflections included in the refinement: 0.1728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No