Information card for entry 7015930

Structure parameters

• Formula: C22 H50 Br3 N3 Ni2 P2
• Calculated formula: C22 H50 Br3 N3 Ni2 P2
• SMILES: Br[Ni]12[Br][Ni]3(Br)[N]2(CC[N]1=P(C(C)C)(C(C)C)C(C)C)CC[N]3=P(C(C)C)(C(C)C)C(C)C
• Title of publication: Oxidative addition of aryl halides: routes to mono- and dimetallic nickel amino-bis-phosphinimine complexes.
• Authors of publication: Cariou, Renan; Graham, Todd W.; Dahcheh, Fatme; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 20
• Pages of publication: 5419 - 5422
• a: 8.4274 ± 0.0011 Å
• b: 14.2654 ± 0.0017 Å
• c: 14.8223 ± 0.0018 Å
• α: 109.086 ± 0.006°
• β: 100.108 ± 0.007°
• γ: 101.114 ± 0.006°
• Cell volume: 1596.8 ± 0.4 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: 0.0626
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No