Information card for entry 4135439

Structure parameters

• Formula: C74 H94 Cl2 Ge2 N4 O2
• Calculated formula: C74 H94 Cl2 Ge2 N4 O2
• Title of publication: Isolation of a Ge(I) Diradicaloid and Dihydrogen Splitting.
• Authors of publication: Sharma, Mahendra K.; Ebeler, Falk; Glodde, Timo; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 13.7437 ± 0.0004 Å
• b: 20.2913 ± 0.0004 Å
• c: 24.8641 ± 0.0004 Å
• α: 90°
• β: 98.358 ± 0.002°
• γ: 90°
• Cell volume: 6860.4 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1263
• Weighted residual factors for all reflections included in the refinement: 0.1325
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No