Information card for entry 7104350

Structure parameters

• Formula: C98 H90 Cl4 F12 N8 O13 P4 Pd2 S4
• Calculated formula: C98 H90 Cl4 F12 N8 O13 P4 Pd2 S4
• Title of publication: Diastereoselective self-assembly of dinuclear heterochiral metallosupramolecular rhombs in a self-discriminating process.
• Authors of publication: Weilandt, Torsten; Kiehne, Ulf; Schnakenburg, Gregor; Lützen, Arne
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 17
• Pages of publication: 2320 - 2322
• a: 17.786 ± 0.0004 Å
• b: 37.444 ± 0.001 Å
• c: 16.408 ± 0.0004 Å
• α: 90°
• β: 111.566 ± 0.001°
• γ: 90°
• Cell volume: 10162.4 ± 0.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1027
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for significantly intense reflections: 0.19
• Weighted residual factors for all reflections included in the refinement: 0.2079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No