Information card for entry 7700973

Structure parameters

• Formula: C22 H34 Si2 Ti
• Calculated formula: C22 H34 Si2 Ti
• Title of publication: Metal-dependent regioselective homocoupling of stannyl- and alkyl-substituted alkynes on group 4 elements. Formation of unsymmetrical titanacyclopentadienes and symmetrical zircona-cyclopentadienes.
• Authors of publication: Bando, Masayoshi; Nakajima, Kiyohiko; Song, Zhiyi; Takahashi, Tamotsu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 37
• Pages of publication: 13912 - 13915
• a: 9.709 ± 0.005 Å
• b: 10.178 ± 0.006 Å
• c: 12.212 ± 0.006 Å
• α: 96.05 ± 0.02°
• β: 95.99 ± 0.02°
• γ: 104.28 ± 0.02°
• Cell volume: 1152.3 ± 1.1 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.0507
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.1254
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No