Information card for entry 7708707

Structure parameters

• Formula: C15 H19 O6 P
• Calculated formula: C15 H19 O6 P
• Title of publication: Umbelliferyloxymethyl Phosphonate Compounds- weakly binding zinc ionophores with neuroprotective properties
• Authors of publication: Guesne, Sebastien; Connole, Laura; Kim, Stephanie; Motevalli, Majid; Robson, Lesley; Michael-Titus, Adina T; Sullivan, Alice
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 16.6014 ± 0.001 Å
• b: 8.812 ± 0.002 Å
• c: 11.132 ± 0.002 Å
• α: 90°
• β: 105.12 ± 0.02°
• γ: 90°
• Cell volume: 1572.1 ± 0.5 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 4
• 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: 0.1878
• Residual factor for significantly intense reflections: 0.0697
• Weighted residual factors for significantly intense reflections: 0.1703
• Weighted residual factors for all reflections included in the refinement: 0.2212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No