Information card for entry 7103488

Structure parameters

• Formula: C37 H46 Ge N2
• Calculated formula: C37 H46 Ge N2
• SMILES: CC1=CC(C)=[N]([Ge](N1c1c(cccc1C(C)C)C(C)C)C#Cc1ccccc1)c1c(cccc1C(C)C)C(C)C
• Title of publication: Striking reactivity of ylide-like germylene toward terminal alkynes: [4+2] cycloaddition versus C-H bond activation.
• Authors of publication: Yao, Shenglai; van Wüllen, Christoph; Driess, Matthias
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 42
• Pages of publication: 5393 - 5395
• a: 14.142 ± 0.0003 Å
• b: 20.5933 ± 0.0006 Å
• c: 11.1905 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3259.01 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0588
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0731
• Weighted residual factors for all reflections included in the refinement: 0.0789
• Goodness-of-fit parameter for all reflections included in the refinement: 0.918
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No