Information card for entry 7720295

Structure parameters

• Formula: C38 H48 D6 Si2 Ti
• Calculated formula: C38 H48 D6 Si2 Ti
• Title of publication: Expanding the Reactivity of Rosenthal's Reagent to Cyclopropenes and Allenes
• Authors of publication: Eilers, Marcel; Geik, Dennis; Schmidtmann, Marc; Doye, Sven; Beckhaus, Ruediger
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 13.1108 ± 0.0006 Å
• b: 10.2423 ± 0.0005 Å
• c: 25.2436 ± 0.0011 Å
• α: 90°
• β: 95.6324 ± 0.0016°
• γ: 90°
• Cell volume: 3373.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0478
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No