Information card for entry 7028790

Structure parameters

• Formula: C18 H19 N O4 P2
• Calculated formula: C18 H19 N O4 P2
• SMILES: P1(c2cc(cc3c4c(c(P5OCCO5)cc(c4)C)[nH]c23)C)OCCO1
• Title of publication: A cascade reaction: ring-opening insertion of dioxaphospholane into lutetium alkyl bonds.
• Authors of publication: Johnson, Kevin R. D.; Hayes, Paul G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 6
• Pages of publication: 2448 - 2457
• a: 8.3969 ± 0.0009 Å
• b: 10.2686 ± 0.001 Å
• c: 10.6756 ± 0.0011 Å
• α: 93.762 ± 0.001°
• β: 111.311 ± 0.001°
• γ: 93.666 ± 0.001°
• Cell volume: 851.88 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0523
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0905
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No