Information card for entry 7025535

Structure parameters

• Formula: C30 H78 B2 O3 P2 Si4 Sm
• Calculated formula: C30 H78 B2 O3 P2 Si4 Sm
• SMILES: [Sm]1234([O]5CCCC5)([O]5CCCC5)([O]5CCCC5)([H][BH]([P](C4([Si](C)(C)C)[Si](C)(C)C)(C)C)[H]1)[H][BH]([P](C3([Si](C)(C)C)[Si](C)(C)C)(C)C)[H]2
• Title of publication: Lanthanide(II) complexes of a phosphine-borane-stabilised carbanion.
• Authors of publication: Izod, Keith; Clegg, William; Harrington, Ross W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 29
• Pages of publication: 6705 - 6709
• a: 13.7414 ± 0.0008 Å
• b: 13.7832 ± 0.0007 Å
• c: 15.9703 ± 0.0008 Å
• α: 66.697 ± 0.005°
• β: 88.844 ± 0.005°
• γ: 70.297 ± 0.005°
• Cell volume: 2592.9 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0607
• Weighted residual factors for all reflections included in the refinement: 0.062
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No