Information card for entry 7043067

Structure parameters

• Formula: C21 H44 Fe Ge O Si3
• Calculated formula: C21 H44 Fe Ge O Si3
• SMILES: [FeH]1234([GeH]C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)(C#[O])[c]5([c]4([c]3([c]2([c]15C)C)C)C)C
• Title of publication: An Iron Germylene Complex Having Fe-H and Ge-H Bonds: Synthesis, Structure and Reactivity
• Authors of publication: Dhungana, Tara Prasad; Hashimoto, Hisako; Tobita, Hiromi
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 11.4411 ± 0.0006 Å
• b: 13.894 ± 0.0009 Å
• c: 16.9772 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2698.7 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0519
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.0997
• Weighted residual factors for all reflections included in the refinement: 0.1024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No