Information card for entry 7037578

Structure parameters

• Formula: C3 H54 Mn2 N7 O55 P V18
• Calculated formula: C3 H12 Mn2 N7 O55 P V18
• Title of publication: Design and synthesis of purely inorganic 3D frameworks composed of reduced vanadium clusters and manganese linkers.
• Authors of publication: Zhou, Yang-Yang; Yao, Shuang; Yan, Jing-Hui; Chen, Li; Wang, Ting-Ting; Wang, Chun-Jie; Zhang, Zhi-Ming
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 47
• Pages of publication: 20435 - 20440
• a: 12.1286 ± 0.0019 Å
• b: 20.336 ± 0.003 Å
• c: 21.324 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5259.5 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0668
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.1564
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No