Information card for entry 2214729

Structure parameters

• Chemical name: (1,1'-Binaphthyl-2,2'-dioxy)diacetic acid
• Formula: C24 H18 O6
• Calculated formula: C24 H18 O6
• SMILES: OC(=O)COc1c(c2c(cc1)cccc2)c1c2c(ccc1OCC(=O)O)cccc2
• Title of publication: (1,1'-Binaphthyl-2,2'-dioxy)diacetic acid
• Authors of publication: Ya-Ming Wu; Guo-Qing Cao; Ming-Yi Qian; Hong-Jun Zhu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3446 - o3446
• a: 7.316 ± 0.0015 Å
• b: 14.067 ± 0.003 Å
• c: 19.386 ± 0.004 Å
• α: 85.55 ± 0.03°
• β: 83.11 ± 0.03°
• γ: 85.5 ± 0.03°
• Cell volume: 1969.9 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1088
• Residual factor for significantly intense reflections: 0.0616
• Weighted residual factors for significantly intense reflections: 0.1369
• Weighted residual factors for all reflections included in the refinement: 0.1848
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes