Information card for entry 7047577

Structure parameters

• Formula: C55 H104 N6 Ni2 O P4 S2
• Calculated formula: C55 H104 N6 Ni2 O P4 S2
• Title of publication: Monomeric nickel hydroxide stabilized by a sterically demanding phosphorus-nitrogen PN³P-pincer ligand: synthesis, reactivity and catalysis.
• Authors of publication: Yao, Changguang; Chakraborty, Priyanka; Aresu, Emanuele; Li, Huaifeng; Guan, Chao; Zhou, Chunhui; Liang, Lan-Chang; Huang, Kuo-Wei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 45
• Pages of publication: 16057 - 16065
• a: 8.677 ± 0.004 Å
• b: 11.612 ± 0.005 Å
• c: 18.416 ± 0.008 Å
• α: 74.03 ± 0.015°
• β: 80.855 ± 0.016°
• γ: 68.967 ± 0.014°
• Cell volume: 1661.3 ± 1.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.058
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1687
• Weighted residual factors for all reflections included in the refinement: 0.1747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.343
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No