Information card for entry 7214245

Structure parameters

• Formula: C27 H29.5 N2 Ni O9.75
• Calculated formula: C27 H28.5 N2 Ni O9.75
• Title of publication: Different interpenetrated coordination polymers based on flexible dicarboxylate ligands: topological diversity and magnetism
• Authors of publication: Liu, Jian-Qiang; Wu, Jian; Wang, Yao-Yu; Lin, Jian-Tao; Sakiyama, Hiroshi
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 15
• Pages of publication: 3103
• a: 23.423 ± 0.004 Å
• b: 11.2363 ± 0.0019 Å
• c: 22.563 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5938.3 ± 1.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 54
• Hermann-Mauguin space group symbol: P c c a
• Hall space group symbol: -P 2a 2ac
• Residual factor for all reflections: 0.1228
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1516
• Weighted residual factors for all reflections included in the refinement: 0.1673
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No