Information card for entry 1517069

Structure parameters

• Formula: C40 H76 Cd5 Mo12 N24 O72 P8
• Calculated formula: C40 H76 Cd5 Mo12 N24 O72 P8
• Title of publication: Ligands directed versatile cadmium-bis(triazole) metal-organic fragments to generate three new two dimensional complexes based on polymolybdenum phosphate
• Authors of publication: Xiu-Li Wang; Jing-Jing Cao; Guo-Cheng Liu; Hong-Yan Lin; Ai-Xiang Tian
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 402
• Pages of publication: 6 - 11
• a: 14.3639 ± 0.001 Å
• b: 14.9311 ± 0.001 Å
• c: 14.949 ± 0.001 Å
• α: 114.38 ± 0.001°
• β: 111.444 ± 0.001°
• γ: 92.437 ± 0.001°
• Cell volume: 2646.4 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0403
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.0964
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No