Information card for entry 2204318

Structure parameters

• Formula: C30 H24 O2
• Calculated formula: C30 H24 O2
• SMILES: O[C@H]1[C@@H]([C@@H](c2c1cccc2)c1ccccc1)[C@@H]1C(=O)c2c([C@H]1c1ccccc1)cccc2.O[C@@H]1[C@H]([C@H](c2c1cccc2)c1ccccc1)[C@H]1C(=O)c2c([C@@H]1c1ccccc1)cccc2
• Title of publication: (2<i>RS</i>,3<i>RS</i>,1'<i>SR</i>,2'<i>SR</i>,3'<i>RS</i>)-2-(2',3'-Dihydro-1'-hydroxy-3'-phenyl-1<i>H</i>-inden-2'-yl)-2,3-dihydro-3-phenylinden-1-one: isomer (I)
• Authors of publication: Ohba, Shigeru; Yohei, Yamamoto; Tanaka, Koichi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: o1793 - o1794
• a: 17.985 ± 0.003 Å
• b: 9.529 ± 0.003 Å
• c: 13.154 ± 0.004 Å
• α: 90°
• β: 99.63 ± 0.02°
• γ: 90°
• Cell volume: 2222.6 ± 1 ų
• Cell temperature: 297 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for all reflections included in the refinement: 0.1668
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes