Information card for entry 1570748

Structure parameters

• Formula: C59 H73 Ge N2 O P5 Si
• Calculated formula: C59 H73 Ge N2 O P5 Si
• Title of publication: Synthesis and reactivity of N-heterocyclic carbene (NHC)-supported heavier nitrile ylides.
• Authors of publication: Sarkar, Debotra; Dutta, Sayan; Hanusch, Franziska; Koley, Debasis; Inoue, Shigeyoshi
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 7
• Pages of publication: 2391 - 2397
• a: 13.13 ± 0.004 Å
• b: 13.51 ± 0.004 Å
• c: 17.559 ± 0.005 Å
• α: 91.771 ± 0.012°
• β: 105.725 ± 0.016°
• γ: 107.874 ± 0.009°
• Cell volume: 2831.2 ± 1.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.039
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0765
• Weighted residual factors for all reflections included in the refinement: 0.0814
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No