Information card for entry 7229247

Structure parameters

• Common name: Zinc diphosphonate ethelenediamine
• Formula: C6 H18 N2 O15 P4 S0 Zn3
• Calculated formula: C6 H18 N2 O15 P4 Zn3
• Title of publication: Novel Amine Templated Three-Dimensional Zinc-Organophosphonates with Variable Pore-Openings
• Authors of publication: Paul, Avijit Kumar; Kanagaraj, Rajendiran; Jana, Ajay; Maji, Pradip
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 20.4135 ± 0.0008 Å
• b: 8.9845 ± 0.0004 Å
• c: 23.0411 ± 0.0009 Å
• α: 90°
• β: 92.499 ± 0.003°
• γ: 90°
• Cell volume: 4221.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0859
• Residual factor for significantly intense reflections: 0.0732
• Weighted residual factors for significantly intense reflections: 0.1702
• Weighted residual factors for all reflections included in the refinement: 0.1805
• 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: No
• Has Fobs: No