Information card for entry 7706468

Structure parameters

• Formula: C25 H36 O Ru
• Calculated formula: C25 H36 O Ru
• SMILES: [Ru]123456(OC(c7c6cccc7)(C(C)(C)C)C(C)(C)C)[cH]6[cH]5[c]4([cH]3[cH]2[c]16C)C(C)C
• Title of publication: Synthesis, characterization, and alkoxide transfer reactivity of dimeric Tl₂(OR)₂ complexes.
• Authors of publication: Grass, Amanda; Kulathungage, Lakshani Wathsala; Wannipurage, Duleeka; Yousif, Maryam; Ward, Cassandra L.; Groysman, Stanislav
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 7
• Pages of publication: 2501 - 2509
• a: 9.3633 ± 0.0008 Å
• b: 11.1104 ± 0.0009 Å
• c: 11.4477 ± 0.0009 Å
• α: 91.329 ± 0.004°
• β: 102.082 ± 0.004°
• γ: 112.349 ± 0.004°
• Cell volume: 1070.07 ± 0.16 ų
• Cell temperature: 100.1 K
• Ambient diffraction temperature: 100.1 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: 0.0309
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0632
• Goodness-of-fit parameter for all reflections included in the refinement: 1.146
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No