Information card for entry 4334728

Structure parameters

• Formula: C16 H30 Fe N4 O2
• Calculated formula: C16 H30 Fe N4 O2
• SMILES: [Fe]12(OC(=C(N=[N]1C(C)(C)C)C)C)OC(=C(N=[N]2C(C)(C)C)C)C
• Title of publication: Synthesis, Structure, and Solution Reduction Reactions of Volatile and Thermally Stable Mid to Late First Row Transition Metal Complexes Containing Hydrazonate Ligands
• Authors of publication: Lakmal C. Kalutarage; Philip D. Martin; Mary Jane Heeg; Charles H. Winter
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 5385 - 5394
• a: 11.2423 ± 0.0009 Å
• b: 8.1136 ± 0.0007 Å
• c: 31.476 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2871.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0798
• Residual factor for significantly intense reflections: 0.0792
• Weighted residual factors for significantly intense reflections: 0.2792
• Weighted residual factors for all reflections included in the refinement: 0.2796
• Goodness-of-fit parameter for all reflections included in the refinement: 2.567
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No