Information card for entry 4347785

Structure parameters

• Common name: (dimethylsilanediyl)bis(methylene) bis(nitrocarbamate)
• Chemical name: (dimethylsilanediyl)bis(methylene) bis(nitrocarbamate)
• Formula: C6 H12 N4 O8 Si
• Calculated formula: C6 H12 N4 O8 Si
• SMILES: [Si](COC(=O)NN(=O)=O)(COC(=O)NN(=O)=O)(C)C
• Title of publication: Energetic Sila-Nitrocarbamates: Silicon Analogues of Neo-Pentane Derivatives.
• Authors of publication: Axthammer, Quirin J.; Klapötke, Thomas M; Krumm, Burkhard; Reith, Thomas
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 4683 - 4692
• a: 7.224 ± 0.0005 Å
• b: 7.411 ± 0.0004 Å
• c: 12.281 ± 0.0006 Å
• α: 83.53 ± 0.004°
• β: 87.158 ± 0.005°
• γ: 81.859 ± 0.005°
• Cell volume: 646.34 ± 0.07 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0499
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.1035
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No