Information card for entry 4121517

Structure parameters

• Formula: C56 H54 B2 Cl2 F8 N4 O2 P2 Pt S2
• Calculated formula: C56 H54 B2 Cl2 F8 N4 O2 P2 Pt S2
• Title of publication: Small molecule regulation of self-association and catalytic activity in a supramolecular coordination complex.
• Authors of publication: McGuirk, C. Michael; Stern, Charlotte L.; Mirkin, Chad A.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 12
• Pages of publication: 4689 - 4696
• a: 10.8806 ± 0.0004 Å
• b: 13.5311 ± 0.0004 Å
• c: 20.3845 ± 0.0007 Å
• α: 83.2982 ± 0.0019°
• β: 80.3787 ± 0.0018°
• γ: 68.0669 ± 0.0017°
• Cell volume: 2739.92 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 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: 0.0641
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.0937
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No