Information card for entry 4312445

Structure parameters

• Formula: C20 H36 N6 Ni O8
• Calculated formula: C20 H36 N8 Ni2 O16
• SMILES: C1(CCCC1)=[N](O)[Ni]12(ON(=[O]1)=O)([N](=C1CCCC1)O)ON(=[O]2)=O
• Title of publication: Facile Ni(II)/Ketoxime-Mediated Conversion of Organonitriles into Imidoylamidine Ligands. Synthesis of Imidoylamidines and Acetyl Amides
• Authors of publication: Maximilian N. Kopylovich; Armando J. L. Pombeiro; Andreas Fischer; Lars Kloo; Vadim Yu. Kukushkin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 7239 - 7248
• a: 13.562 ± 0.002 Å
• b: 11.828 ± 0.001 Å
• c: 10.483 ± 0.002 Å
• α: 90°
• β: 111.51 ± 0.01°
• γ: 90°
• Cell volume: 1564.5 ± 0.4 ų
• Cell temperature: 297 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0752
• Weighted residual factors for all reflections included in the refinement: 0.0822
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No