Information card for entry 7245636

Structure parameters

• Formula: C36 H34 Cu N2 O8
• Calculated formula: C36 H34 Cu N2 O8
• Title of publication: Design of Coordination Polymers based on combinations of 1,2-diphenylethane-1,2-diyl diisonicotinate with Cu(II), Zn(II), Cd(II) and Co(II)
• Authors of publication: Zazouli, Sofia; Kyritsakas, Nathalie; Bulach, Veronique; Ferlay, Sylvie; Jouaiti, Abdelaziz
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 17.1498 ± 0.0009 Å
• b: 6.2278 ± 0.0004 Å
• c: 17.3103 ± 0.0009 Å
• α: 90°
• β: 118.787 ± 0.002°
• γ: 90°
• Cell volume: 1620.35 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0764
• Residual factor for significantly intense reflections: 0.0614
• Weighted residual factors for significantly intense reflections: 0.1515
• Weighted residual factors for all reflections included in the refinement: 0.1624
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No