Information card for entry 7021045

Structure parameters

• Formula: C42 H43 F6 N4 Ni P3
• Calculated formula: C42 H43 F6 N4 Ni P3
• SMILES: [NiH]12[N](=P(c3ccccc3)(c3ccccc3)c3ccccc3)CC[NH]1CC[N]2=P(c1ccccc1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-].C(#N)C
• Title of publication: Synthesis and reactivity of nickel-hydride amino-bis-phosphinimine complexes.
• Authors of publication: Cariou, Renan; Graham, Todd W.; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 12
• Pages of publication: 4237 - 4239
• a: 11.2878 ± 0.0009 Å
• b: 12.0048 ± 0.0009 Å
• c: 16.3353 ± 0.0011 Å
• α: 99.854 ± 0.002°
• β: 100.657 ± 0.002°
• γ: 106.872 ± 0.002°
• Cell volume: 2021.4 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0866
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1161
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No