Information card for entry 7042209

Structure parameters

• Common name: NioMP2Py
• Formula: C35 H41 N3 Ni O2
• Calculated formula: C35 H41 N3 Ni O2
• SMILES: c1(ccccc1C(C)(C)C)O[Ni]([n]1ccccc1)([n]1ccccc1)([n]1ccccc1)Oc1ccccc1C(C)(C)C
• Title of publication: Synthesis and characterization of a series of nickel(II) alkoxide precursors and their utility for Ni(0) nanoparticle production
• Authors of publication: Treadwell, LaRico J.; Boyle, Timothy J.; Phelan, W. Adam; Parkes, Marie V.; Young, David P.
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 12.6799 ± 0.0016 Å
• b: 13.4323 ± 0.0016 Å
• c: 19.632 ± 0.002 Å
• α: 90°
• β: 98.808 ± 0.007°
• γ: 90°
• Cell volume: 3304.3 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.2131
• Residual factor for significantly intense reflections: 0.0769
• Weighted residual factors for significantly intense reflections: 0.1622
• Weighted residual factors for all reflections included in the refinement: 0.2204
• Goodness-of-fit parameter for all reflections included in the refinement: 0.932
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No