Information card for entry 7118460

Structure parameters

• Formula: C150 H101 Cu4 I3 La6 N12 O39
• Calculated formula: C150 H96 Cu4 I3 La6 N12 O39
• Title of publication: Halogen dependent symmetry change in two series of wheel cluster organic frameworks built from La18 tertiary building units.
• Authors of publication: Fang, Wei-Hui; Zhang, Lei; Zhang, Jian; Yang, Guo-Yu
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 7
• Pages of publication: 1455 - 1457
• a: 13.0142 ± 0.0003 Å
• b: 13.0142 ± 0.0003 Å
• c: 51.3233 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7528 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.1036
• Residual factor for significantly intense reflections: 0.0955
• Weighted residual factors for significantly intense reflections: 0.2446
• Weighted residual factors for all reflections included in the refinement: 0.2509
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No