Information card for entry 1571427

Structure parameters

• Formula: C44 H50 Cl4 Mn N6 O6
• Calculated formula: C44 H50 Cl4 Mn N6 O6
• Title of publication: Therapeutic coordination polymers: tailoring drug release through metal-ligand interactions.
• Authors of publication: Murphy, Jennifer N.; Kobti, Joy-Lynn; Dao, Michelle; Wear, Darcy; Okoko, Michael; Pandey, Siyaram; Vukotic, V. Nicholas
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 19
• Pages of publication: 7041 - 7050
• a: 8.5583 ± 0.0009 Å
• b: 21.737 ± 0.003 Å
• c: 12.8769 ± 0.0019 Å
• α: 90°
• β: 108.475 ± 0.014°
• γ: 90°
• Cell volume: 2272.1 ± 0.5 ų
• Cell temperature: 170 K
• Ambient diffraction temperature: 170 K
• Number of distinct elements: 6
• 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: 0.1362
• Residual factor for significantly intense reflections: 0.0754
• Weighted residual factors for significantly intense reflections: 0.1829
• Weighted residual factors for all reflections included in the refinement: 0.2346
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No