Information card for entry 4512470

Structure parameters

• Formula: C138 H258 Mo24 N6 O98 P2 Zn8
• Calculated formula: C138 H238 Mo24 N6 O92 P2 Zn8
• Title of publication: Tuning the Dimensionality of Polyoxometalate-Based Materials by Using a Mixture of Ligands
• Authors of publication: Rousseau, Guillaume; Rodriguez-Albelo, Luisa Marleny; Salomon, William; Mialane, Pierre; Marrot, Jérôme; Doungmene, Floriant; Mbomekallé, Israël-Martyr; de Oliveira, Pedro; Dolbecq, Anne
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 1
• Pages of publication: 449
• a: 21.6854 ± 0.0009 Å
• b: 29.7276 ± 0.0011 Å
• c: 34.8286 ± 0.0014 Å
• α: 90°
• β: 96.342 ± 0.001°
• γ: 90°
• Cell volume: 22315 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.128
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1097
• Weighted residual factors for all reflections included in the refinement: 0.133
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No