Information card for entry 7102648

Structure parameters

• Formula: C238 H224 B3 Cu4 F15 N32 O18 S Zn4
• Calculated formula: C238 H200 B3 Cu4 F15 N32 O18 S Zn4
• Title of publication: Programmed Single Step Self-assembly of a [2x2] Grid Architecture Built on Metallic Centers of Different Coordination Geometries
• Authors of publication: Jean-Marie Lehn; Nathalie Kyritsakas; A. Petitjean
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 10
• Pages of publication: 1168 - 1169
• a: 17.8009 ± 0.0003 Å
• b: 18.2756 ± 0.0003 Å
• c: 21.3141 ± 0.0004 Å
• α: 79.087 ± 0.005°
• β: 66.993 ± 0.005°
• γ: 67.425 ± 0.005°
• Cell volume: 5887.1 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.243
• Residual factor for significantly intense reflections: 0.105
• Weighted residual factors for all reflections: 0.661
• Weighted residual factors for all reflections included in the refinement: 0.137
• Goodness-of-fit parameter for all reflections: 10.909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.264
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No