Information card for entry 4306593

Structure parameters

• Formula: C76 H44 Cl6 Ge2 N12 O9
• Calculated formula: C74 H42 Ge2 N12 O9
• SMILES: [Ge]123(O[Ge]456n7c8cc(N(=O)=O)c7C(=c7n4c(cc7)=C(c4[n]5c(cc4)=C(c4n6c8cc4N(=O)=O)c4ccccc4)c4ccccc4)c4ccccc4)n4c5cc(N(=O)=O)c4C(=c4n1c(cc4)=C(c1[n]2c(cc1)=C(c1n3c5cc1N(=O)=O)c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: β-Nitro Derivatives of Germanium(IV) Corrolates
• Authors of publication: Marco Mastroianni; Weihua Zhu; Manuela Stefanelli; Sara Nardis; Frank R. Fronczek; Kevin M. Smith; Zhongping Ou; Karl M. Kadish; Roberto Paolesse
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11680 - 11687
• a: 18.634 ± 0.002 Å
• b: 16.1855 ± 0.0015 Å
• c: 23.728 ± 0.004 Å
• α: 90°
• β: 94.528 ± 0.006°
• γ: 90°
• Cell volume: 7134 ± 1.6 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No