Information card for entry 7222110

Structure parameters

• Formula: C21 H34 O23 P6 Tb2
• Calculated formula: C21 H33.9996 O23 P6 Tb2
• Title of publication: Lanthanide diphosphonates based on a V-shaped ligand: syntheses, structures, experimental and theoretical luminescence properties
• Authors of publication: Tang, Si-Fu; Li, Xuebing
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 40
• Pages of publication: 7723
• a: 16.0134 ± 0.0011 Å
• b: 16.0134 ± 0.0011 Å
• c: 16.0134 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4106.3 ± 0.5 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 199
• Hermann-Mauguin space group symbol: I 21 3
• Hall space group symbol: I 2b 2c 3
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0782
• Weighted residual factors for all reflections included in the refinement: 0.0868
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No