Information card for entry 2212728

Structure parameters

• Chemical name: 5-O-<i>tert</i>-Butyldiphenylsilyl-2-C-hydroxymethyl- 2,3-O-isopropylidene-2'-O-trifluoromethanesulfonyl-D-ribono-1,4-lactone
• Formula: C26 H31 F3 O8 S Si
• Calculated formula: C26 H31 F3 O8 S Si
• SMILES: O1C(=O)[C@]2([C@@H]([C@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)OC(O2)(C)C)COS(=O)(=O)C(F)(F)F
• Title of publication: 5-<i>O</i>-<i>tert</i>-Butyldiphenylsilyl-2-<i>C</i>-hydroxymethyl-2,3-<i>O</i>-isopropylidene-2'-<i>O</i>-trifluoromethanesulfonyl-<small>D</small>-ribono-1,4-lactone
• Authors of publication: Simone, Michela; Fleet, George W. J.; Watkin, David J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 3
• Pages of publication: o1088 - o1090
• a: 7.7889 ± 0.0001 Å
• b: 17.0479 ± 0.0003 Å
• c: 21.2824 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2825.97 ± 0.07 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for all reflections included in the refinement: 0.0333
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0621
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes