Information card for entry 7103018

Structure parameters

• Formula: C122.75 H140.5 Cu8 Ga4 O45.5
• Calculated formula: C122.75 H93 Cu12 O45.5
• Title of publication: Rapid formation of metal-organic nano-capsules gives new insight into the self-assembly process.
• Authors of publication: Dalgarno, Scott J; Power, Nicholas P; Warren, John E; Atwood, Jerry L
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 13
• Pages of publication: 1539 - 1541
• a: 21.206 ± 0.003 Å
• b: 21.834 ± 0.003 Å
• c: 23.544 ± 0.005 Å
• α: 110.972 ± 0.002°
• β: 110.134 ± 0.002°
• γ: 98.955 ± 0.002°
• Cell volume: 9060 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1179
• Residual factor for significantly intense reflections: 0.0816
• Weighted residual factors for significantly intense reflections: 0.2178
• Weighted residual factors for all reflections included in the refinement: 0.2316
• Goodness-of-fit parameter for all reflections included in the refinement: 1.283
• Diffraction radiation wavelength: 0.6907 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No