Information card for entry 1570524

Structure parameters

• Formula: C45 H40 N Ni O P
• Calculated formula: C45 H40 N Ni O P
• Title of publication: Regulating the polyethylene microstructure by increasing steric crowding in naphthoxy imine-ligated Ni(ii) complexes
• Authors of publication: Birajdar, Rajkumar S.; Gonnade, Rajesh G.; Chikkali, Samir H.
• Journal of publication: Polymer Chemistry
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 4
• Pages of publication: 292 - 302
• a: 9.3181 ± 0.0012 Å
• b: 10.1498 ± 0.0012 Å
• c: 19.648 ± 0.002 Å
• α: 103.844 ± 0.004°
• β: 97.992 ± 0.005°
• γ: 92.327 ± 0.004°
• Cell volume: 1781.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0586
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0888
• Weighted residual factors for all reflections included in the refinement: 0.0979
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No