Information card for entry 4106542

Structure parameters

• Formula: C42 H54 Ge
• Calculated formula: C42 H54 Ge
• Title of publication: C-H Activation of Cycloalkenes by Dimetallynes (M = Ge, Sn) under Ambient Conditions
• Authors of publication: Owen T. Summerscales; James C. Fettinger; Philip P. Power
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 11960 - 11963
• a: 15.8497 ± 0.0012 Å
• b: 25.8968 ± 0.0011 Å
• c: 17.0594 ± 0.0007 Å
• α: 90°
• β: 95.87°
• γ: 90°
• Cell volume: 6965.4 ± 0.7 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.074
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No