Information card for entry 7042210

Structure parameters

• Common name: Nio2MP2PY
• Formula: C44 H44 N6 Ni O2
• Calculated formula: C44 H44 N6 Ni O2
• SMILES: Cc1c(cccc1)O[Ni]([n]1ccccc1)([n]1ccccc1)([n]1ccccc1)([n]1ccccc1)Oc1ccccc1C.n1ccccc1.n1ccccc1
• 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: 10.0616 ± 0.0014 Å
• b: 10.629 ± 0.0015 Å
• c: 10.9455 ± 0.0016 Å
• α: 78.105 ± 0.006°
• β: 64.315 ± 0.005°
• γ: 64.238 ± 0.005°
• Cell volume: 949.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.0645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No