Information card for entry 7045405

Structure parameters

• Formula: C82 H92 Cl14 N8 O14 Zn4
• Calculated formula: C82 H92 Cl14 N8 O14 Zn4
• Title of publication: Studies towards the synthesis of Pd(ii)-containing [2] and [3]catenanes in aqueous media.
• Authors of publication: López-Vidal, E M; Prokofjevs, A.; Gibbs-Hall, I C; Dale, E. J.; Quintela, J. M.; Peinador, C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 8
• Pages of publication: 2492 - 2496
• a: 14.528 ± 0.001 Å
• b: 16.6911 ± 0.0012 Å
• c: 20.7097 ± 0.0014 Å
• α: 105.917 ± 0.003°
• β: 91.108 ± 0.003°
• γ: 105.758 ± 0.003°
• Cell volume: 4623.9 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 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: 0.0737
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1951
• Weighted residual factors for all reflections included in the refinement: 0.2022
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No