Information card for entry 4080520

Structure parameters

• Formula: C65 H101 N Si3
• Calculated formula: C65 H101 N Si3
• Title of publication: Functionalized Cyclic Disilenes via Ring Expansion of Cyclotrisilenes with Isocyanides
• Authors of publication: Ohmori, Yu; Ichinohe, Masaaki; Sekiguchi, Akira; Cowley, Michael J.; Huch, Volker; Scheschkewitz, David
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 6
• Pages of publication: 1591
• a: 11.8268 ± 0.0005 Å
• b: 25.7252 ± 0.001 Å
• c: 21.1322 ± 0.0008 Å
• α: 90°
• β: 105.904 ± 0.002°
• γ: 90°
• Cell volume: 6183.3 ± 0.4 ų
• Cell temperature: 112 ± 2 K
• Ambient diffraction temperature: 112 ± 2 K
• Number of distinct elements: 4
• 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: 0.0733
• Residual factor for significantly intense reflections: 0.0504
• Weighted residual factors for significantly intense reflections: 0.1144
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No