Information card for entry 7249298

Structure parameters

• Formula: C42 H27.5 Gd N4.5 O6.62
• Calculated formula: C42 H27.5 Gd N4.5 O6.625
• Title of publication: Pillared lanthanide metal organic frameworks with sinusoidal channels formed from bent mixed-donor phenanthroline based ligands of different length.
• Authors of publication: Wang, Shengyu; Macreadie, Lauren; Hanton, Lyall R.
• Journal of publication: CrystEngComm
• Year of publication: 2024
• a: 24.8521 ± 0.0012 Å
• b: 15.2782 ± 0.0004 Å
• c: 29.4804 ± 0.0011 Å
• α: 90°
• β: 94.618 ± 0.004°
• γ: 90°
• Cell volume: 11157.2 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1811
• Residual factor for significantly intense reflections: 0.0935
• Weighted residual factors for significantly intense reflections: 0.2557
• Weighted residual factors for all reflections included in the refinement: 0.3105
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No