Information card for entry 2200955

Structure parameters

• Chemical name: [(2R,5S)-2,5-Bis(4-nitrophenyl)perhydrofuro[2,3-b]furan-3-yl]triisopropylsilane
• Formula: C27 H36 N2 O6 Si
• Calculated formula: C27 H36 N2 O6 Si
• SMILES: c1(ccc(cc1)[C@H]1CC2(C[C@@H](c3ccc(cc3)N(=O)=O)OC2O1)[Si](C(C)C)(C(C)C)C(C)C)N(=O)=O
• Title of publication: [(2<i>R</i>,5<i>S</i>)-2,5-Bis(4-nitrophenyl)perhydrofuro[2,3-<i>b</i>]furan-3-yl]triisopropylsilane
• Authors of publication: Light, Mark E.; Hursthouse, Michael B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 3
• Pages of publication: o252 - o253
• a: 11.4829 ± 0.0003 Å
• b: 14.5419 ± 0.0003 Å
• c: 15.7595 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2631.57 ± 0.11 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0421
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0812
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes