Information card for entry 7126280

Structure parameters

• Formula: C12 H37 Ca N2 O17 P4
• Calculated formula: C12 H37 Ca N2 O17 P4
• Title of publication: Self-sacrificial MOFs for ultra-long controlled release of bisphosphonate anti-osteoporotic drugs.
• Authors of publication: Vassaki, Maria; Papathanasiou, Konstantinos E.; Hadjicharalambous, Chrystalleni; Chandrinou, Daphne; Turhanen, Petri; Choquesillo-Lazarte, Duane; Demadis, Konstantinos D.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 38
• Pages of publication: 5166 - 5169
• a: 31.0593 ± 0.0013 Å
• b: 5.1776 ± 0.0002 Å
• c: 21.8198 ± 0.0009 Å
• α: 90°
• β: 130.591 ± 0.002°
• γ: 90°
• Cell volume: 2664.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No