Information card for entry 7131524

Structure parameters

• Formula: C46 H106 Al2 N Nd O6 Si2
• Calculated formula: C46 H106 Al2 N Nd O6 Si2
• SMILES: C1C[O]2CC[O]3CC[O]4CC[O]5CC[O]6CC[O]1[Nd]23456(N([Si](C)(C)C)[Si](C)(C)C)[H][Al](CC(C)C)(CC(C)C)CC(C)C.C(C(C)C)[Al](CC(C)C)(CC(C)C)CC(C)C
• Title of publication: Triisobutylaluminium-promoted formation of lanthanide hydrides.
• Authors of publication: Moinet, Eric C.; Tardif, Olivier; Maichle-Mössmer, Cäcilia; Anwander, Reiner
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 35
• Pages of publication: 5261 - 5264
• a: 14.132 ± 0.0017 Å
• b: 15.5704 ± 0.0019 Å
• c: 26.282 ± 0.003 Å
• α: 90°
• β: 91.616 ± 0.002°
• γ: 90°
• Cell volume: 5780.8 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0633
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No