Information card for entry 7047353

Structure parameters

• Chemical name: Y{CH[N(Dipp)]2}2(THF)(OCP)
• Formula: C55 H78 N4 O2 P Y
• Calculated formula: C55 H78 N4 O2 P Y
• 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: 12.3914 ± 0.0005 Å
• b: 13.6795 ± 0.0006 Å
• c: 15.9103 ± 0.0006 Å
• α: 94.764 ± 0.003°
• β: 91.951 ± 0.003°
• γ: 97.911 ± 0.003°
• Cell volume: 2659.2 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0335
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.082
• Weighted residual factors for all reflections included in the refinement: 0.0831
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No