Information card for entry 1555090

Structure parameters

• Formula: C32 H32 O P2
• Calculated formula: C32 H32 O P2
• SMILES: C1(=C([C@]2(CP1P1C(=C(C(=C1[C@@H]2c1ccc(cc1)OC)C)C)c1ccccc1)C)C)c1ccccc1.C1(=C([C@@]2(CP1P1C(=C(C(=C1[C@H]2c1ccc(cc1)OC)C)C)c1ccccc1)C)C)c1ccccc1
• Title of publication: Reaction of Phospholes with Aldimines: A One-Step Synthesis of Chelating, Alpha-C2-Bridged Biphospholes.
• Authors of publication: Hu, Zhengsong; Li, Zongyang; Zhao, Kang; Tian, Rongqiang; Duan, Zheng; Mathey, François
• Journal of publication: Organic letters
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 14
• Pages of publication: 3518 - 3520
• a: 14.7596 ± 0.0008 Å
• b: 10.4392 ± 0.0006 Å
• c: 17.7877 ± 0.0005 Å
• α: 90°
• β: 105.924 ± 0.004°
• γ: 90°
• Cell volume: 2635.5 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 4
• 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: 0.0487
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.1107
• Weighted residual factors for all reflections included in the refinement: 0.1173
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No