Information card for entry 4084776

Structure parameters

• Formula: C39.5 H50 Ni O3 P2 Si
• Calculated formula: C39.5 H50 Ni O3 P2 Si
• Title of publication: POCOP-Ligated Nickel Siloxide Complexes: Syntheses, Characterization, and Reactivities
• Authors of publication: Hao, Jingjun; Vabre, Boris; Zargarian, Davit
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 22
• Pages of publication: 6568
• a: 12.5999 ± 0.0003 Å
• b: 10.9706 ± 0.0003 Å
• c: 27.2347 ± 0.0007 Å
• α: 90°
• β: 90.844 ± 0.001°
• γ: 90°
• Cell volume: 3764.2 ± 0.17 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.033
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0874
• Weighted residual factors for all reflections included in the refinement: 0.0882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No