Information card for entry 7047356

Structure parameters

• Chemical name: Nd{CH[N(Dipp)]2}2(THF)(OCP)
• Formula: C55 H78 N4 Nd O2 P
• Calculated formula: C55 H78 N4 Nd O2 P
• Title of publication: Synthesis and reactivity of rare-earth metal phosphaethynolates.
• Authors of publication: Bestgen, Sebastian; Chen, Qien; Rees, Nicholas H.; Goicoechea, Jose M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 37
• Pages of publication: 13016 - 13024
• a: 16.2099 ± 0.0003 Å
• b: 16.9858 ± 0.0003 Å
• c: 29.5661 ± 0.0008 Å
• α: 80.844 ± 0.002°
• β: 83.341 ± 0.002°
• γ: 86.754 ± 0.002°
• Cell volume: 7976.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0601
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1166
• Weighted residual factors for all reflections included in the refinement: 0.1286
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No