Information card for entry 4073415

Structure parameters

• Formula: C28 H48 I P2 Tm
• Calculated formula: C28 H48 I P2 Tm
• SMILES: [Tm]12345678(I)(P9[C]4(=[C]3([C]2(=[C]19C(C)(C)C)C)C)C(C)(C)C)P1[C]5(=[C]6([C]7(=[C]81C(C)(C)C)C)C)C(C)(C)C
• Title of publication: Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands
• Authors of publication: Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 14
• Pages of publication: 3552
• a: 10.787 ± 0.001 Å
• b: 16.997 ± 0.001 Å
• c: 16.458 ± 0.001 Å
• α: 90°
• β: 91.982 ± 0.001°
• γ: 90°
• Cell volume: 3015.7 ± 0.4 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.092
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No