Information card for entry 7704776

Structure parameters

• Formula: C108.2 H160.36 I42 Lu2 N16 O16.42 S9.42 W18
• Calculated formula: C108.2 H160.36 I42 Lu2 N16 O16.42 S9.42 W18
• Title of publication: Energy transfer in supramolecular [Crypt-RE]-[W₆I₁₄] solids.
• Authors of publication: Hummel, Thorsten; Leis, Wolfgang; Eckhardt, Aaron; Ströbele, Markus; Enseling, David; Jüstel, Thomas; Meyer, Hans-Jürgen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 28
• Pages of publication: 9795 - 9803
• a: 14.576 ± 0.006 Å
• b: 24.514 ± 0.011 Å
• c: 30.756 ± 0.013 Å
• α: 90°
• β: 101.658 ± 0.005°
• γ: 90°
• Cell volume: 10763 ± 8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0934
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.1468
• Weighted residual factors for all reflections included in the refinement: 0.1722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No