Information card for entry 7037329

Structure parameters

• Formula: C26 H42 Al Cl Ge
• Calculated formula: C26 H42 Al Cl Ge
• SMILES: [Ge]1([Cl][Al](/C1=C/C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C#CC(C)(C)C)c1ccccc1
• Title of publication: Functionalized alkynyl-chlorogermanes: hydrometallation, Ge-Cl bond activation, Ge-H bond formation and chlorine-tert-butyl exchange via a transient germyl cation.
• Authors of publication: Honacker, Christian; Qu, Zheng-Wang; Tannert, Jens; Layh, Marcus; Hepp, Alexander; Grimme, Stefan; Uhl, Werner
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 6159 - 6174
• a: 10.1763 ± 0.0005 Å
• b: 10.7259 ± 0.0005 Å
• c: 13.9537 ± 0.0006 Å
• α: 80.891 ± 0.001°
• β: 74.815 ± 0.001°
• γ: 89.831 ± 0.001°
• Cell volume: 1450.15 ± 0.12 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.029
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.07
• Weighted residual factors for all reflections included in the refinement: 0.0717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No