Information card for entry 2225975

Structure parameters

• Chemical name: 3,9-Di-1-naphthyl-2,4,8,10-tetraoxaspiro[5.5]undecane
• Formula: C27 H24 O4
• Calculated formula: C27 H24 O4
• SMILES: O1CC2(COC(OC2)c2cccc3ccccc23)COC1c1cccc2c1cccc2
• Title of publication: 3,9-Di-1-naphthyl-2,4,8,10-tetraoxaspiro[5.5]undecane
• Authors of publication: Zhang, Xiuqin; Cui, Yuan; Yu, Bin; Sun, Xiaoqiang; Chen, Qiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: o1191
• a: 14.904 ± 0.0015 Å
• b: 5.7761 ± 0.0006 Å
• c: 24.238 ± 0.002 Å
• α: 90°
• β: 95.447 ± 0.002°
• γ: 90°
• Cell volume: 2077.2 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.0631
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.136
• Weighted residual factors for all reflections included in the refinement: 0.1577
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes