Information card for entry 2007486

Structure parameters

• Chemical name: (1R,2R)-Cyclopentane-1,2-diyl-bis[(4'S,5'S)-4',5'-diisopropoxycarbonyl- 1'3',2'-dioxaphospholane]
• Formula: C25 H40 O12 P2
• Calculated formula: C25 H40 O12 P2
• SMILES: P1(O[C@@H]([C@H](O1)C(=O)OC(C)C)C(=O)OC(C)C)[C@H]1[C@H](P2O[C@@H]([C@H](O2)C(=O)OC(C)C)C(=O)OC(C)C)CCC1
• Title of publication: Chiral Bisphosphanes. IV. Tetraisopropyl 2,2'-[(1<i>R</i>,2<i>R</i>)-Cyclopentane-1,2-diyl]bis[(4<i>S</i>,5<i>S</i>)-1,3,2-dioxaphospholane-4,5-dicarboxylate]
• Authors of publication: Dahlenburg, Lutz; Kaunert, Anja
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 7
• Pages of publication: 1016 - 1017
• a: 9.68 ± 0.003 Å
• b: 17.611 ± 0.004 Å
• c: 10.076 ± 0.002 Å
• α: 90°
• β: 116.96 ± 0.02°
• γ: 90°
• Cell volume: 1531 ± 0.7 ų
• Cell temperature: 178 ± 2 K
• Ambient diffraction temperature: 178 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0587
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections: 0.1414
• Weighted residual factors for all reflections included in the refinement: 0.1399
• Goodness-of-fit parameter for all reflections: 1.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No