Information card for entry 1568595

Structure parameters

• Formula: C192 H224 Cl42 O189.6 W18
• Calculated formula: C192 H224 Cl42 O189.6 W18
• Title of publication: Supramolecular Host–Guest Assemblies of [M6Cl14]2–, M = Mo, W, Clusters with γ-Cyclodextrin for the Development of CLUSPOMs
• Authors of publication: Ivanov, Anton A.; Abramov, Pavel A.; Haouas, Mohamed; Molard, Yann; Cordier, Stéphane; Falaise, Clément; Cadot, Emmanuel; Shestopalov, Michael A.
• Journal of publication: Inorganics
• Year of publication: 2023
• Journal volume: 11
• Journal issue: 2
• Pages of publication: 77
• a: 35.7254 ± 0.0005 Å
• b: 35.7254 ± 0.0005 Å
• c: 34.3472 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 43837.5 ± 1.8 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 5
• Space group number: 97
• Hermann-Mauguin space group symbol: I 4 2 2
• Hall space group symbol: I 4 2
• Residual factor for all reflections: 0.1326
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1563
• Weighted residual factors for all reflections included in the refinement: 0.1922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No