Information card for entry 4346506

Structure parameters

• Formula: C46 H130 I N9 Na6 O2 Si10
• Calculated formula: C46 H130 I N9 Na6 O2 Si10
• SMILES: [I]1234[Na]5[N]([Na]1[N]([Na]2[N]([Na]3[N]([Na]4[N]5([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.[Na]1234([O](CC[N]1(C)C)CC[N]2(C)C)[N](C)(C)CC[O]4CC[N]3(C)C
• Title of publication: Synthetic and Structural Studies of Mixed Sodium Bis(trimethylsilyl)amide/Sodium Halide Aggregates in the Presence of η(2)-N,N-, η(3)-N,N,N/N,O,N-, and η(4)-N,N,N,N-Donor Ligands.
• Authors of publication: Ojeda-Amador, Ana I; Martínez-Martínez, Antonio J; Kennedy, Alan R.; O'Hara, Charles T
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 20
• Pages of publication: 9833 - 9844
• a: 19.4798 ± 0.0006 Å
• b: 31.7695 ± 0.0003 Å
• c: 29.0262 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 17963.3 ± 0.6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0919
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1085
• Weighted residual factors for all reflections included in the refinement: 0.1198
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No