Information card for entry 7720678

Structure parameters

• Common name: Magnesium alkoxide complex
• Chemical name: Intermediate_Int_1
• Formula: C70 H82.5 Mg2 N4 O2
• Calculated formula: C70 H82.5 Mg2 N4 O2
• Title of publication: Catalytic Hydroboration of α,β-Unsaturated Ketones Using β-Diketiminate Magnesium Hydride and Mechanistic Insights
• Authors of publication: Das, Anubhab; Mukhopadhyay, Sayantan; Rajput, Sagrika; Nembenna, Sharanappa
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 10.6672 ± 0.0002 Å
• b: 12.469 ± 0.0002 Å
• c: 13.4602 ± 0.0002 Å
• α: 70.343 ± 0.001°
• β: 68.974 ± 0.002°
• γ: 72.713 ± 0.001°
• Cell volume: 1541.7 ± 0.05 ų
• Cell temperature: 99.99 ± 0.1 K
• Ambient diffraction temperature: 99.99 ± 0.1 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: 0.0502
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1297
• Weighted residual factors for all reflections included in the refinement: 0.1313
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No