Information card for entry 1518280

Structure parameters

• Chemical name: 3,6-dipropargyloxymethyl-1,4-dioxane-2,5-dione
• Formula: C12 H12 O6
• Calculated formula: C6 H6 O3
• Title of publication: Synthesis and click chemistry of a new class of biodegradable polylactide towards tunable thermo-responsive biomaterials.
• Authors of publication: Zhang, Quanxuan; Ren, Hong; Baker, Gregory L.
• Journal of publication: Polymer chemistry
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 8
• Pages of publication: 1275 - 1285
• a: 7.6482 ± 0.0012 Å
• b: 7.4766 ± 0.0011 Å
• c: 10.4304 ± 0.0016 Å
• α: 90°
• β: 102.535 ± 0.006°
• γ: 90°
• Cell volume: 582.22 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0825
• Weighted residual factors for all reflections included in the refinement: 0.0991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.269
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No