Information card for entry 7133012

Structure parameters

• Formula: C27 H42 N4 O5 Si
• Calculated formula: C26.997 H41.993 N4 O5 Si
• Title of publication: Stereoselective synthesis of an advanced <i>trans</i>-decalin intermediate towards the total synthesis of anthracimycin.
• Authors of publication: Jeanmard, Laksamee; Lodovici, Giacomo; George, Ian; Bray, Joshua T. W.; Whitwood, Adrian C.; Thomas, Gavin H.; Fairlamb, Ian J. S.; Unsworth, William P.; Clarke, Paul A.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 44
• Pages of publication: 5699 - 5702
• a: 12.838 ± 0.0006 Å
• b: 15.169 ± 0.0005 Å
• c: 15.0877 ± 0.0005 Å
• α: 90°
• β: 102.909 ± 0.004°
• γ: 90°
• Cell volume: 2863.91 ± 0.19 ų
• Cell temperature: 110 ± 0.14 K
• Ambient diffraction temperature: 110 ± 0.14 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0606
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No