Information card for entry 7128550

Structure parameters

• Formula: C18 H25 Cl4 F6 N4 Ni O P
• Calculated formula: C18 H25 Cl4 F6 N4 Ni O P
• Title of publication: Photoreductive chlorine elimination from a Ni(iii)Cl₂ complex supported by a tetradentate pyridinophane ligand.
• Authors of publication: Na, Hanah; Watson, Michael B.; Tang, Fengzhi; Rath, Nigam P.; Mirica, Liviu M.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 59
• Pages of publication: 7264 - 7267
• a: 19.4628 ± 0.0006 Å
• b: 13.3212 ± 0.0004 Å
• c: 9.6192 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2493.95 ± 0.13 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0323
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.104
• Goodness-of-fit parameter for all reflections included in the refinement: 0.969
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No