Information card for entry 7135260

Structure parameters

• Formula: C33 H68 Al Mg N5 Si4
• Calculated formula: C33 H68 Al Mg N5 Si4
• Title of publication: Intriguing Metal-Ligand Interplays Leading to Diverse Al-H-M (M = Mg, Ca) Heterobimetallic Hydrides on a Picolyl-Based 3N Ligand
• Authors of publication: Mandal, Chhotan; Kundu, Abhishek; Panda, Sourav; Mukherjee, Debabrata
• Journal of publication: Chemical Communications
• Year of publication: 2025
• a: 12.85853 ± 0.00005 Å
• b: 20.3422 ± 0.00009 Å
• c: 32.09584 ± 0.00012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8395.33 ± 0.06 ų
• Cell temperature: 99.98 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0442
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.1121
• Weighted residual factors for all reflections included in the refinement: 0.1135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No