Information card for entry 7132848

Structure parameters

• Formula: C43 H57 N4 Ni P2 Sc
• Calculated formula: C43 H57 N4 Ni P2 Sc
• Title of publication: A scandium metalloligand supported Ni(0) complex with a heterobimetallocycle: versatile reactivity with unsaturated bonds.
• Authors of publication: Ma, Lei; Pan, Xiaowei; Hong, Dongjing; Fang, Huayi; Cui, Peng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 31
• Pages of publication: 4222 - 4225
• a: 11.122 ± 0.002 Å
• b: 11.696 ± 0.002 Å
• c: 16.447 ± 0.003 Å
• α: 101.88 ± 0.003°
• β: 96.172 ± 0.003°
• γ: 90.996 ± 0.003°
• Cell volume: 2079.8 ± 0.6 ų
• Cell temperature: 293.15 K
• Ambient diffraction temperature: 293.15 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: 0.1561
• Residual factor for significantly intense reflections: 0.0607
• Weighted residual factors for significantly intense reflections: 0.1091
• Weighted residual factors for all reflections included in the refinement: 0.1395
• Goodness-of-fit parameter for all reflections included in the refinement: 0.954
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No