Information card for entry 4335620

Structure parameters

• Formula: C18 H130 Mo24 N20 O125 P4
• Calculated formula: C18 H12 Mo24 N20 O125 P4
• Title of publication: Carboxylate-Functionalized Phosphomolybdates: Ligand-Directed Conformations
• Authors of publication: Donghui Yang; Suzhi Li; Pengtao Ma; Jingping Wang; Jingyang Niu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 8987 - 8992
• a: 16.5531 ± 0.0019 Å
• b: 30.271 ± 0.003 Å
• c: 30.99 ± 0.004 Å
• α: 90°
• β: 94.132 ± 0.003°
• γ: 90°
• Cell volume: 15488 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.1635
• Residual factor for significantly intense reflections: 0.1116
• Weighted residual factors for significantly intense reflections: 0.2662
• Weighted residual factors for all reflections included in the refinement: 0.2832
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No