Information card for entry 1563996

Structure parameters

• Formula: C20 H22 Cl2 N2 Ni O7
• Calculated formula: C20 H22 Cl2 N2 Ni O7
• Title of publication: Macrocyclic mononuclear Ni(II) and macroacyclic tetranuclear Cu(II) complexes: Dimerization of binuclear Cu(II) complexes with help of perchlorate anions
• Authors of publication: Golbedaghi, Reza; Fausto, Rui; Salehzadeh, Sadegh; Tofani, Manijeh; Safaraabadi, Soraya
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2018
• Journal volume: 480
• Pages of publication: 27 - 32
• a: 11.901 ± 0.002 Å
• b: 17.67 ± 0.004 Å
• c: 10.903 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2292.8 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.175
• Residual factor for significantly intense reflections: 0.076
• Weighted residual factors for significantly intense reflections: 0.1027
• Weighted residual factors for all reflections included in the refinement: 0.1243
• Goodness-of-fit parameter for all reflections included in the refinement: 0.895
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No