Information card for entry 4078198

Structure parameters

• Formula: C30 H52 Si4
• Calculated formula: C30 H52 Si4
• SMILES: [Si@]1(c2ccccc2[Si@@](C(C)C)(C)CC[Si@@](c2ccccc2[Si@]1(C(C)C)C)(C(C)C)C)(C(C)C)C.[Si@@]1(c2ccccc2[Si@](C(C)C)(C)CC[Si@](c2ccccc2[Si@@]1(C(C)C)C)(C(C)C)C)(C(C)C)C
• Title of publication: Stereochemistry of Disilanylene-Containing Cyclic Compounds. Palladium-Catalyzed Reactions ofcis- andtrans-3,4-Benzo-1,2-diisopropyl-1,2-dimethyl-1,2-disilacyclobut-3-ene with Ethylene
• Authors of publication: Naka, Akinobu; Ohshita, Joji; Miyazaki, Eigo; Miura, Toshiko; Kobayashi, Hisayoshi; Ishikawa, Mitsuo
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 9
• Pages of publication: 3492
• a: 11.4827 ± 0.0003 Å
• b: 19.1784 ± 0.0004 Å
• c: 29.1806 ± 0.0006 Å
• α: 90°
• β: 91.6079 ± 0.0006°
• γ: 90°
• Cell volume: 6423.6 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 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 all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1455
• Weighted residual factors for all reflections included in the refinement: 0.1545
• Goodness-of-fit parameter for all reflections included in the refinement: 1.247
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No