Information card for entry 7115905

Structure parameters

• Formula: C21 H15 Cu3 N3 O30.75
• Calculated formula: C21 H15 Cu3 N3 O30.75
• Title of publication: The influence of the enantiomeric ratio of an organic ligand on the structure and chirality of metal-organic frameworks
• Authors of publication: Ivan Burneo; Kyriakos C. Stylianou; Inhar Imaz; Daniel Maspoch
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 13829
• a: 34.172 ± 0.005 Å
• b: 34.172 ± 0.005 Å
• c: 34.172 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 39904 ± 10 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 196
• Hermann-Mauguin space group symbol: F 2 3
• Hall space group symbol: F 2 2 3
• Residual factor for all reflections: 0.092
• Residual factor for significantly intense reflections: 0.0828
• Weighted residual factors for significantly intense reflections: 0.277
• Weighted residual factors for all reflections included in the refinement: 0.2926
• Goodness-of-fit parameter for all reflections included in the refinement: 1.323
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No