Information card for entry 7251259

Structure parameters

• Formula: C18 H22 N4 Ni O6
• Calculated formula: C18 H22 N4 Ni O6
• Title of publication: Crystal engineering of Nickel(II) coordination networks sustained by aliphatic dicarboxylate linker ligands
• Authors of publication: Zaworotko, Michael; Singh, Bharti; He, Tao
• Journal of publication: CrystEngComm
• Year of publication: 2025
• a: 5.2255 ± 0.0002 Å
• b: 9.0139 ± 0.0003 Å
• c: 11.0579 ± 0.0003 Å
• α: 108.563 ± 0.001°
• β: 94.7 ± 0.001°
• γ: 104.557 ± 0.001°
• Cell volume: 470.4 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 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: 0.0197
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.0441
• Goodness-of-fit parameter for all reflections included in the refinement: 1.148
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No