Information card for entry 7114058

Structure parameters

• Formula: C60 H98 Mo10 N12 Ni5 O70 P4
• Calculated formula: C60 H50 Mo10 N12 Ni5 O70 P4
• Title of publication: A novel compound with an interpenetrating 2D network structure constructed by [Mo5P2O23] and Ni???4,4???-bipyridine components: its synthesis, characterization and magnetic behaviour
• Authors of publication: Chen, Jin; Lu, Shaofang; Yu, Rongmin; Chen, Zhongning; Huang, Zixiang; Lu, Canzhong
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 22
• Pages of publication: 2640
• a: 10.7192 ± 0.0002 Å
• b: 31.0886 ± 0.0006 Å
• c: 16.469 ± 0.0003 Å
• α: 90°
• β: 104.331 ± 0.001°
• γ: 90°
• Cell volume: 5317.43 ± 0.17 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: 0.0783
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.1118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No