Information card for entry 1504513

Structure parameters

• Common name: 07226a
• Formula: C22 H31 N O4
• Calculated formula: C22 H31 N O4
• SMILES: O=C1OC[C@H](N1[C@H]1[C@@H]([C@@H]1CCCCC)C(=O)OC(C)(C)C)c1ccccc1
• Title of publication: A mutually pi-facial selective cyclopropanation of chiral enamides using dirhodium(II) carbenoids.
• Authors of publication: Lu, Ting; Song, Zhenlei; Hsung, Richard P.
• Journal of publication: Organic letters
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 4
• Pages of publication: 541 - 544
• a: 6.0884 ± 0.0005 Å
• b: 16.1018 ± 0.0013 Å
• c: 21.8321 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2140.3 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0422
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1023
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No