Information card for entry 7005807

Structure parameters

• Common name: (Trihapto-2-methyl-allyl)-bis(diisopropyl-allyl-phosphino)- nickel (ii) tetrakis(3,5-bis(trifluoromethyl)phenyl)borate
• Chemical name: (Trihapto-2-methyl-allyl)-bis(diisopropyl-allyl-phosphino)-nickel (II) tetrakis{3,5-bis(trifluoromethyl)phenyl}borate
• Formula: C54 H57 B F24 Ni P2
• Calculated formula: C54 H57 B F24 Ni P2
• 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: 12.799 ± 0.003 Å
• b: 11.98 ± 0.002 Å
• c: 37.938 ± 0.008 Å
• α: 90°
• β: 99.13 ± 0.03°
• γ: 90°
• Cell volume: 5743 ± 2 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.086
• Residual factor for significantly intense reflections: 0.077
• Weighted residual factors for significantly intense reflections: 0.154
• Weighted residual factors for all reflections included in the refinement: 0.1594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No