Information card for entry 7016405

Structure parameters

• Formula: C30 H23 N Ni O5 P2
• Calculated formula: C30 H23 N Ni O5 P2
• Title of publication: The impact of P-substituents on the structures, spectroscopic properties, and reactivities of POCOP-type pincer complexes of nickel(ii).
• Authors of publication: Salah, Abderrahmen B.; Zargarian, Davit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 35
• Pages of publication: 8977 - 8985
• a: 16.548 ± 0.002 Å
• b: 11.3201 ± 0.0015 Å
• c: 16.655 ± 0.002 Å
• α: 90°
• β: 119.769 ± 0.002°
• γ: 90°
• Cell volume: 2708.2 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0369
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No