Information card for entry 7056047

Structure parameters

• Formula: C33 H38 Co2 N6 O10
• Calculated formula: C33 H38 Co2 N6 O10
• Title of publication: Synthesis, structures and photoluminescence properties of mixed ligand divalent metal‒organic frameworks
• Authors of publication: Altaf, Muhammad; Mansha, Muhammad; Sohail, Manzar; Isab, Anvarhusein A.; Ullah, Nisar; Khan, Safyan A.; Sher, Muhammad; Stoeckli-Evans, Helen
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 8
• Pages of publication: 2980
• a: 18.3638 ± 0.0012 Å
• b: 10.9135 ± 0.0004 Å
• c: 18.8942 ± 0.0011 Å
• α: 90°
• β: 108.374 ± 0.005°
• γ: 90°
• Cell volume: 3593.6 ± 0.4 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0793
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No