Information card for entry 1517654

Structure parameters

• Formula: C28 H40 N4 Ni2 O9.5
• Calculated formula: C28 H40 N4 Ni2 O9.5
• Title of publication: Eight coordination compounds based on a reduced Schiff base tetraaminodiphenol macrocyclic ligand
• Authors of publication: Ying-Ying Liu; Jie Liu; Jin Yang; Bo Liu; Jian-Fang Ma
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 403
• Pages of publication: 85 - 96
• a: 10.336 ± 0.004 Å
• b: 12.175 ± 0.006 Å
• c: 12.76 ± 0.005 Å
• α: 97.378 ± 0.016°
• β: 105.934 ± 0.014°
• γ: 98.935 ± 0.018°
• Cell volume: 1500.4 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0777
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1154
• Weighted residual factors for all reflections included in the refinement: 0.1294
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No