Information card for entry 1574562

Structure parameters

• Formula: C24 H25 Cl N2 O7
• Calculated formula: C24 H25 Cl N2 O7
• Title of publication: Crystal structures of sandwich-type potassium cation complexes formed from benzo-15-crown-5-based ligand containing a chloromaleimide moiety
• Authors of publication: Hirayama, Yuto; Ito, Akitaka; Ochi, Rika
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 20
• Pages of publication: 3214 - 3218
• a: 14.6695 ± 0.0005 Å
• b: 8.4232 ± 0.0002 Å
• c: 19.7536 ± 0.0006 Å
• α: 90°
• β: 108.105 ± 0.004°
• γ: 90°
• Cell volume: 2319.99 ± 0.13 ų
• Cell temperature: 113.15 K
• Ambient diffraction temperature: 113.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0532
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No