Information card for entry 7005806

Structure parameters

• Common name: dibromo-bis(allyldiisopropylphosphine)-nickel (ii)
• Chemical name: dibromo-bis(allyldiisopropylphosphine)-nickel (II)
• Formula: C18 H38 Br2 Ni P2
• Calculated formula: C18 H38 Br2 Ni P2
• SMILES: CC(C)[P]([Ni](Br)([P](CC=C)(C(C)C)C(C)C)Br)(CC=C)C(C)C
• Title of publication: Oligomerization and regioselective hydrosilylation of styrenes catalyzed by cationic allyl nickel complexes bearing allylphosphine ligands.
• Authors of publication: Hyder, Iqbal; Jiménez-Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 28
• Pages of publication: 3000 - 3009
• a: 8.2979 ± 0.0017 Å
• b: 15.238 ± 0.003 Å
• c: 9.339 ± 0.0019 Å
• α: 90°
• β: 104.4 ± 0.03°
• γ: 90°
• Cell volume: 1143.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0272
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0588
• Weighted residual factors for all reflections included in the refinement: 0.0592
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No