Information card for entry 1519302

Structure parameters

• Formula: C27 H36 N2 O6 Si
• Calculated formula: C27 H36 N2 O6 Si
• SMILES: C12(C(O[C@H](C1)c1ccc(cc1)N(=O)=O)O[C@H](C2)c1ccc(cc1)N(=O)=O)[Si](C(C)C)(C(C)C)C(C)C.C12(C(O[C@@H](C1)c1ccc(cc1)N(=O)=O)O[C@@H](C2)c1ccc(cc1)N(=O)=O)[Si](C(C)C)(C(C)C)C(C)C
• Title of publication: ((2R,5R)-2,5-bis(4-Nitrophenyl)perhydrofuro(2,3-b)furan-3-yl)triisopropylsilane
• Authors of publication: Hursthouse, Michael B.; Coles, Simon J.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 2001
• Pages of publication: 108
• a: 7.9703 ± 0.0016 Å
• b: 12.128 ± 0.002 Å
• c: 14.121 ± 0.003 Å
• α: 79.14 ± 0.03°
• β: 83.06 ± 0.03°
• γ: 77.29 ± 0.03°
• Cell volume: 1303.2 ± 0.5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0576
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.1278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No