Information card for entry 7702486

Structure parameters

• Formula: C48.83 H63.66 B Cl1.66 Ni P2
• Calculated formula: C48.83 H62.66 B Cl1.66 Ni P2
• Title of publication: Structural characterisation of cationic methylallyl, methylindenyl and pentamethylcyclopentadienyl nickel complexes containing the bulky phosphine 1,2-bis(diisopropylphosphino)ethane †
• Authors of publication: Tenorio, Manuel Jiménez; Puerta, M. Carmen; Salcedo, Isabel; Valerga, Pedro
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 5
• Pages of publication: 653
• a: 13.252 ± 0.003 Å
• b: 16.619 ± 0.004 Å
• c: 10.964 ± 0.005 Å
• α: 100.65 ± 0.02°
• β: 105.09 ± 0.02°
• γ: 94.31 ± 0.02°
• Cell volume: 2271.8 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 290 ± 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: 0.146
• Residual factor for significantly intense reflections: 0.1025
• Weighted residual factors for significantly intense reflections: 0.2966
• Weighted residual factors for all reflections included in the refinement: 0.3924
• Goodness-of-fit parameter for all reflections included in the refinement: 1.261
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No