Information card for entry 1517121

Structure parameters

• Formula: C48 H38 Co5 N18 O18 P6
• Calculated formula: C48 H38 Co5 N18 O18 P6
• Title of publication: Syntheses, structures and magnetic properties of two isostructural metal-phosphonate frameworks
• Authors of publication: Fupeng Zhai; Mingli Deng; Yun Ling; Zhenxia Chen; Linhong Weng; Yaming Zhou
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 402
• Pages of publication: 104 - 108
• a: 9.4189 ± 0.0007 Å
• b: 26.248 ± 0.002 Å
• c: 11.4511 ± 0.0009 Å
• α: 90°
• β: 95.618 ± 0.001°
• γ: 90°
• Cell volume: 2817.4 ± 0.4 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: 0.0367
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0916
• Weighted residual factors for all reflections included in the refinement: 0.1055
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No