Information card for entry 1542413

Structure parameters

• Formula: C26 H44 O2 Si2
• Calculated formula: C26 H44 O2 Si2
• SMILES: [Si](OC1C2C3C4C1C1C2C2C3C3C4C1C2C3O[Si](C)(C)C(C)(C)C)(C(C)(C)C)(C)C
• Title of publication: Catalytic Cage Formation via Controlled Dimerization of Norbornadienes: An Entry to Functionalized HCTDs (Heptacyclo[6.6.0.0(2,6).0(3,13).0(4,11).0(5,9).0(10,14)]tetradecanes).
• Authors of publication: Lim, Hee Nam; Dong, Guangbin
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 5
• Pages of publication: 1104
• a: 30.17 ± 0.02 Å
• b: 6.495 ± 0.004 Å
• c: 13.388 ± 0.008 Å
• α: 90°
• β: 92.76 ± 0.012°
• γ: 90°
• Cell volume: 2620 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1156
• Weighted residual factors for all reflections included in the refinement: 0.1299
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No