Information card for entry 7017375

Structure parameters

• Formula: C107 H89 F24 N36 O29 S8 Zn4
• Calculated formula: C107 H89 F24 N36 O29 S8 Zn4
• Title of publication: Structural and metallo selectivity in the assembly of [2 ×2] grid-type metallosupramolecular species: Mechanisms and kinetic control.
• Authors of publication: Stefankiewicz, Artur R.; Harrowfield, Jack; Madalan, Augustin; Rissanen, Kari; Sobolev, Alexandre N.; Lehn, Jean-Marie
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 45
• Pages of publication: 12320 - 12332
• a: 17.6293 ± 0.001 Å
• b: 42.351 ± 0.003 Å
• c: 21.3809 ± 0.0012 Å
• α: 90°
• β: 109.905 ± 0.003°
• γ: 90°
• Cell volume: 15009.7 ± 1.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2366
• Residual factor for significantly intense reflections: 0.1182
• Weighted residual factors for significantly intense reflections: 0.3081
• Weighted residual factors for all reflections included in the refinement: 0.3604
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No