Information card for entry 7054006

Structure parameters

• Formula: C72 H58 Ce5 N4 O34
• Calculated formula: C72 H58 Ce5 N4 O34
• Title of publication: Fast and continuous processing of a new sub-micronic lanthanide-based metal‒organic framework
• Authors of publication: D'Arras, Loïc; Sassoye, Capucine; Rozes, Laurence; Sanchez, Clément; Marrot, Jérôme; Marre, Samuel; Aymonier, Cyril
• Journal of publication: New Journal of Chemistry
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 4
• Pages of publication: 1477
• a: 14.1051 ± 0.0013 Å
• b: 15.3365 ± 0.0013 Å
• c: 17.8162 ± 0.0015 Å
• α: 89.985 ± 0.004°
• β: 86.89 ± 0.004°
• γ: 89.747 ± 0.004°
• Cell volume: 3848.3 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.1738
• Residual factor for significantly intense reflections: 0.16
• Weighted residual factors for significantly intense reflections: 0.3717
• Weighted residual factors for all reflections included in the refinement: 0.3781
• Goodness-of-fit parameter for all reflections included in the refinement: 1.178
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No