Information card for entry 7029725

Structure parameters

• Formula: C46 H54 N P
• Calculated formula: C46 H54 N P
• Title of publication: Tetrahydropentalenyl-phosphazene constrained geometry complexes of rare-earth metal alkyls.
• Authors of publication: Hangaly, Noa K; Petrov, Alexander R; Elfferding, Michael; Harms, Klaus; Sundermeyer, Jörg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 19
• Pages of publication: 7109 - 7120
• a: 10.6538 ± 0.001 Å
• b: 10.6835 ± 0.0007 Å
• c: 33.496 ± 0.003 Å
• α: 90°
• β: 97.266 ± 0.012°
• γ: 90°
• Cell volume: 3781.9 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0967
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.1613
• Goodness-of-fit parameter for all reflections included in the refinement: 0.832
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No