Information card for entry 4111311

Structure parameters

• Formula: C30 H42 O5 Si
• Calculated formula: C30 H42 O5 Si
• SMILES: [Si](OC1=C[C@@H](c2ccccc2)[C@H](C=C2[C@H]1C(C(=O)OC)(C(=O)OC)C=C2)C)(C(C)C)(C(C)C)C(C)C.[Si](OC1=C[C@H](c2ccccc2)[C@@H](C=C2[C@@H]1C(C(=O)OC)(C(=O)OC)C=C2)C)(C(C)C)(C(C)C)C(C)C
• Title of publication: W(CO)5(L)-Catalyzed Tandem Intramolecular Cyclopropanation/Cope Rearrangement for the Stereoselective Construction of Bicyclo[5.3.0]decane Framework
• Authors of publication: Hiroyuki Kusama; Yuji Onizawa; Nobuharu Iwasawa
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 16500 - 16501
• a: 11.173 ± 0.016 Å
• b: 12.582 ± 0.018 Å
• c: 21.63 ± 0.03 Å
• α: 79.19 ± 0.05°
• β: 81.02 ± 0.06°
• γ: 77.41 ± 0.06°
• Cell volume: 2894 ± 7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0628
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1562
• Weighted residual factors for all reflections included in the refinement: 0.1645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No