Information card for entry 2009081

Structure parameters

• Chemical name: 2-trimethylgermylethyl p-nitrobenzoate
• Formula: C12 H17 Ge N O4
• Calculated formula: C12 H17 Ge N O4
• SMILES: [Ge](CCOC(=O)c1ccc(N(=O)=O)cc1)(C)(C)C
• Title of publication: Trimethylgermylethyl <i>p</i>-nitrobenzoate
• Authors of publication: White, Jonathan M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 10
• Pages of publication: 1660 - 1662
• a: 12.67 ± 0.002 Å
• b: 7.368 ± 0.001 Å
• c: 29.704 ± 0.005 Å
• α: 90°
• β: 96.92 ± 0.01°
• γ: 90°
• Cell volume: 2752.7 ± 0.7 ų
• Cell temperature: 130 ± 0.1 K
• Ambient diffraction temperature: 130 ± 1 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.032
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for all reflections: 0.085
• Weighted residual factors for significantly intense reflections: 0.081
• Goodness-of-fit parameter for all reflections: 0.977
• Goodness-of-fit parameter for significantly intense reflections: 0.992
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes