Information card for entry 2217547

Structure parameters

• Chemical name: 6,10,16,19-Tetraoxatrispiro[4.2.2.4.2.2]nonadecane
• Formula: C15 H24 O4
• Calculated formula: C15 H24 O4
• SMILES: C1CCC2(C1)OCC1(CO2)COC2(OC1)CCCC2
• Title of publication: 6,10,16,19-Tetraoxatrispiro[4.2.2.4.2.2]nonadecane
• Authors of publication: Wang, Ji-Kui; Wang, Hai-Bo; Wu, Cong-Ren; Wang, Jin-Tang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 2
• Pages of publication: o498 - o498
• a: 25.605 ± 0.005 Å
• b: 5.582 ± 0.0011 Å
• c: 10.337 ± 0.002 Å
• α: 90°
• β: 90.22 ± 0.03°
• γ: 90°
• Cell volume: 1477.4 ± 0.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 3
• 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: 0.1155
• Residual factor for significantly intense reflections: 0.0674
• Weighted residual factors for significantly intense reflections: 0.1434
• Weighted residual factors for all reflections included in the refinement: 0.1734
• Goodness-of-fit parameter for all reflections included in the refinement: 0.931
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes