Information card for entry 7109656

Structure parameters

• Formula: C357.33 H712 In6 N2 O156.67 P3
• Calculated formula: C144 H72 In6 O44 P3
• Title of publication: Two homochiral organocatalytic metal organic materials with nanoscopic channels
• Authors of publication: Zhuxiu Zhang; Young Ran Ji; Lukasz Wojtas; Wen-Yang Gao; Shengqian Ma; Michael J. Zaworotko; Jon C. Antilla
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 7693
• a: 31.1023 ± 0.0019 Å
• b: 31.1023 ± 0.0019 Å
• c: 45.205 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 37871 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1066
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.41328 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No