Information card for entry 7239440

Structure parameters

• Formula: C20 H28 Cl N3 Ni2 O8
• Calculated formula: C20 H28 Cl N3 Ni2 O8
• Title of publication: A unique coordination polymer with tetranuclear nickel(ii) units linked by macrocyclic ligands
• Authors of publication: Zhou, Hong; Chen, Xiao Hong; Sun, Wen Wu; Mei, Yu; Pan, Zhi Quan
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 10
• Pages of publication: 5080
• a: 8.1495 ± 0.0016 Å
• b: 12.326 ± 0.002 Å
• c: 13.247 ± 0.003 Å
• α: 63.004 ± 0.003°
• β: 76.91 ± 0.002°
• γ: 85.28 ± 0.003°
• Cell volume: 1154.5 ± 0.4 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0811
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1084
• Weighted residual factors for all reflections included in the refinement: 0.1127
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No