Information card for entry 1575961

Structure parameters

• Formula: C23 H30 N2 O7
• Calculated formula: C23 H30 N2 O7
• Title of publication: Design and synthesis of macrocycles with tuneable diameters and helical foldamers with customizable peripheral side chains.
• Authors of publication: Farooq, Saquib; Crochet, Aurelien; Kilbinger, Andreas F. M.
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 43
• Pages of publication: 20570 - 20579
• a: 32.3295 ± 0.0016 Å
• b: 8.6597 ± 0.0004 Å
• c: 16.7533 ± 0.0008 Å
• α: 90°
• β: 103.483 ± 0.004°
• γ: 90°
• Cell volume: 4561 ± 0.4 ų
• Cell temperature: 250 ± 2 K
• Ambient diffraction temperature: 250 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.081
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1329
• Weighted residual factors for all reflections included in the refinement: 0.1515
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No