Information card for entry 4334724

Structure parameters

• Formula: C17 H38 N5 Ni O2
• Calculated formula: C18 H34 N4 Ni O2
• SMILES: [Ni]12(OC(=CN=[N]1C(C)(C)C)C(C)C)OC(=CN=[N]2C(C)(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: 10.7214 ± 0.0006 Å
• b: 11.3118 ± 0.0006 Å
• c: 34.7526 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4214.7 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0411
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.1446
• Weighted residual factors for all reflections included in the refinement: 0.1534
• Goodness-of-fit parameter for all reflections included in the refinement: 1.266
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No