Information card for entry 2007519

Structure parameters

• Chemical name: (RS,RS)-1,2-(1-Dinaphthyl)-1,2-diphenyl-ethan-1,2-diol
• Formula: C34 H26 O2
• Calculated formula: C34 H26 O2
• SMILES: O[C@]([C@@](O)(c1c2ccccc2ccc1)c1ccccc1)(c1c2ccccc2ccc1)c1ccccc1.O[C@@]([C@](O)(c1c2ccccc2ccc1)c1ccccc1)(c1c2ccccc2ccc1)c1ccccc1
• Title of publication: α-Naphthyl Phenyl Pinacols
• Authors of publication: Mak, Thomas C.W.; Patrick, Brian O.; Rettig, Steven J.; Scheffer, John R.; Trotter, James; Ukpabi, Pauline; Wu, Bo-Mu; Yee, Vivien C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 1148 - 1151
• a: 12.5595 ± 0.0003 Å
• b: 18.7907 ± 0.0007 Å
• c: 10.375 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2448.5 ± 0.5 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.072
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.113
• Goodness-of-fit parameter for all reflections: 1.3
• Goodness-of-fit parameter for all reflections included in the refinement: 1.3
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes