Information card for entry 2236921

Structure parameters

• Chemical name: Bis{bis[2-(diisopropylphosphanyl)phenyl]phosphanido- κ^3^<i>P</i>,<i>P</i>',<i>P</i>''}chloridonickel(II)
• Formula: C24 H36 Cl Ni P3
• Calculated formula: C24 H36 Cl Ni P3
• SMILES: [Ni]12(P(c3ccccc3[P]2(C(C)C)C(C)C)c2ccccc2[P]1(C(C)C)C(C)C)Cl
• Title of publication: Bis{bis[2-(diisopropylphosphanyl)phenyl]phosphanido-κ^3^<i>P</i>,<i>P</i>',<i>P</i>''}chloridonickel(II)
• Authors of publication: Tedesco, Consiglia; Lamberti, Marina; Mazzeo, Mina
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 12
• Pages of publication: m1459
• a: 13.752 ± 0.003 Å
• b: 11.978 ± 0.002 Å
• c: 15.554 ± 0.004 Å
• α: 90°
• β: 101.043 ± 0.017°
• γ: 90°
• Cell volume: 2514.6 ± 1 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: 0.061
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.1081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes