Information card for entry 7015764

Structure parameters

• Formula: C55 H114 Li Mg N7 Si6
• Calculated formula: C55 H114 Li Mg N7 Si6
• SMILES: [Mg](N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C.[Li]12([N]34CCCC[C@H]3[C@H]3C[C@@H](C4)[C@@H]4[N]1(C3)CCCC4)[N]13C[C@H]4[C@H]5[N]2(CCCC5)C[C@H](C4)[C@H]1CCCC3.Cc1ccccc1
• Title of publication: Synthesis and structural chemistry of alkali metal tris(HMDS) magnesiates containing chiral diamine donor ligands.
• Authors of publication: García-Álvarez, Pablo; Kennedy, Alan R.; O'Hara, Charles T; Reilly, Kieran; Robertson, Gemma M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 19
• Pages of publication: 5332 - 5341
• a: 17.28 ± 0.0005 Å
• b: 17.3017 ± 0.0005 Å
• c: 22.0598 ± 0.0006 Å
• α: 90°
• β: 90.512 ± 0.005°
• γ: 90°
• Cell volume: 6595 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1122
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1098
• Weighted residual factors for all reflections included in the refinement: 0.1257
• Goodness-of-fit parameter for all reflections included in the refinement: 0.835
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No