Information card for entry 7030911

Structure parameters

• Common name: 1a
• Formula: C24 H30 Cl4 N6 Ni2 O2
• Calculated formula: C24 H30 Cl4 N6 Ni2 O2
• SMILES: c1cccc2[n]1[Ni]1([OH]C)(Cl)([n]3c(N2C)cccc3)[Cl][Ni]2([n]3ccccc3N(C)c3[n]2cccc3)([OH]C)(Cl)[Cl]1
• Title of publication: The synthesis and application of novel Ni(ii) N-alkyl dipyridylaldiminato complexes as selective ethylene oligomerisation catalysts.
• Authors of publication: Swarts, Andrew J.; Mapolie, Selwyn F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 26
• Pages of publication: 9892 - 9900
• a: 8.486 ± 0.0014 Å
• b: 14.43 ± 0.002 Å
• c: 11.5135 ± 0.0019 Å
• α: 90°
• β: 95.387 ± 0.002°
• γ: 90°
• Cell volume: 1403.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0305
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0553
• Weighted residual factors for all reflections included in the refinement: 0.0581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No