Information card for entry 7152854

Structure parameters

• Common name: 03csf003
• Formula: C23 H27 N O4
• Calculated formula: C23 H27 N O4
• SMILES: O([C@H]1[C@@H](C[C@@]2(C(=C1)[C@@H]1OC[C@@](O)([C@@H]1[C@H](C2)C)C)C#N)C)C(=O)c1ccccc1
• Title of publication: Towards the enantioselective synthesis of (-)-euonyminol‒preparation of a fully functionalised lower-rim model.
• Authors of publication: Webber, Matthew J; Warren, Sarah A; Grainger, Damian M; Weston, Matthew; Clark, Stacy; Woodhead, Steven J; Powell, Lyn; Stokes, Stephen; Alanine, Alexander; Stonehouse, Jeffrey P; Frampton, Christopher S; White, Andrew J P; Spivey, Alan C
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2013
• Journal volume: 11
• Journal issue: 15
• Pages of publication: 2514 - 2533
• a: 6.2151 ± 0.0002 Å
• b: 16.8252 ± 0.0005 Å
• c: 9.7311 ± 0.0004 Å
• α: 90°
• β: 90.176 ± 0.001°
• γ: 90°
• Cell volume: 1017.58 ± 0.06 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 120 ± 1 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0761
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1087
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No