Information card for entry 7104641

Structure parameters

• Common name: JunII201
• Formula: C147 H92 B2 Cl10 F40 N6 O4 P4 Rh2 S4
• Calculated formula: C147 H92 B2 Cl10 F40 N6 O4 P4 Rh2 S4
• Title of publication: Pseudo-allosteric regulation of the anion binding affinity of a macrocyclic coordination complex.
• Authors of publication: Kuwabara, Junpei; Yoon, Hyo Jae; Mirkin, Chad A; DiPasquale, Antonio G; Rheingold, Arnold L
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 30
• Pages of publication: 4557 - 4559
• a: 11.7786 ± 0.0007 Å
• b: 15.513 ± 0.0009 Å
• c: 22.6329 ± 0.0015 Å
• α: 71.65 ± 0.004°
• β: 75.085 ± 0.003°
• γ: 71.629 ± 0.003°
• Cell volume: 3667.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1018
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No