Information card for entry 4085237

Structure parameters

• Formula: C15 H20 Cl2 Fe Ge N2 O4
• Calculated formula: C15 H20 Cl2 Fe Ge N2 O4
• SMILES: C(#[O])[Fe](C#[O])(C#[O])(C#[O])[Ge](=C1N(C(=C(C)N1C(C)C)C)C(C)C)(Cl)Cl
• Title of publication: Iron Complexes with Stabilized Germylenes: Syntheses and Characterizations
• Authors of publication: El Ezzi, Mohammad; Kocsor, Tibor-Gabor; D’Accriscio, Florian; Madec, David; Mallet-Ladeira, Sonia; Castel, Annie
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 3
• Pages of publication: 571
• a: 9.8524 ± 0.0002 Å
• b: 12.9959 ± 0.0003 Å
• c: 16.0149 ± 0.0003 Å
• α: 90°
• β: 94.719 ± 0.001°
• γ: 90°
• Cell volume: 2043.61 ± 0.07 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• 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: 0.043
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0588
• Weighted residual factors for all reflections included in the refinement: 0.0641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No