Information card for entry 7134727

Structure parameters

• Formula: C107 H81 Ce2 N2 O20
• Calculated formula: C107 H81 Ce2 N2 O20
• Title of publication: Rare-earth-pentacene-octacarboxylate frameworks for highly efficient urinary 1-HP fluorescence sensing.
• Authors of publication: Zhang, Jinli; Xi, Xiao-Juan; Xu, Lin; Lang, Feifan; Yang, Yan; Pang, Jiandong
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 60
• Pages of publication: 11195 - 11198
• a: 12.0155 ± 0.0003 Å
• b: 15.2802 ± 0.0002 Å
• c: 19.6685 ± 0.0003 Å
• α: 91.682 ± 0.001°
• β: 94.913 ± 0.002°
• γ: 102.427 ± 0.002°
• Cell volume: 3509.32 ± 0.12 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0917
• Residual factor for significantly intense reflections: 0.0873
• Weighted residual factors for significantly intense reflections: 0.2506
• Weighted residual factors for all reflections included in the refinement: 0.2558
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No