Information card for entry 7220442

Structure parameters

• Formula: C78 H48 Cd3 O14 P2
• Calculated formula: C78 H48 Cd3 O14 P2
• Title of publication: Coordination polymers constructed from a tripodal phosphoryl carboxylate ligand: synthesis, structures and physical properties
• Authors of publication: Yang, Yan-Yan; Lin, Zu-Jin; Liang, Jun; Huang, Yuanbiao; Cao, Rong
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 24
• Pages of publication: 4547
• a: 23.7697 ± 0.0004 Å
• b: 23.7697 ± 0.0004 Å
• c: 23.7697 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13429.8 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 206
• Hermann-Mauguin space group symbol: I a -3
• Hall space group symbol: -I 2b 2c 3
• Residual factor for all reflections: 0.1314
• Residual factor for significantly intense reflections: 0.0967
• Weighted residual factors for significantly intense reflections: 0.2967
• Weighted residual factors for all reflections included in the refinement: 0.338
• Goodness-of-fit parameter for all reflections included in the refinement: 1.174
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No