Information card for entry 7207229

Structure parameters

• Formula: C26 H26 Fe N4 Ni O11
• Calculated formula: C26 H20 Fe N4 Ni O11
• Title of publication: New metalloligands suitable for the construction of polynuclear complexes and coordination polymers with exposed metal sites
• Authors of publication: Li, Xiao-Zeng; Hao, Peng-Peng; Wang, Dan; Zhang, Wen-Qin; Zhu, Li-Na
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 2
• Pages of publication: 366
• a: 15.932 ± 0.003 Å
• b: 8.8699 ± 0.0019 Å
• c: 19.24 ± 0.004 Å
• α: 90°
• β: 91.679 ± 0.004°
• γ: 90°
• Cell volume: 2717.7 ± 1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1434
• Weighted residual factors for all reflections included in the refinement: 0.1455
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No