Information card for entry 4320293

Structure parameters

• Formula: C236 H236 Ga4 K4 N19 O36
• Calculated formula: C222 H113 Ga4 K6 N15 O47
• Title of publication: The Self-Assembly of a [Ga4L6]12- Tetrahedral Cluster Thermodynamically Driven by Host-Guest Interactions
• Authors of publication: Darren W. Johnson; Kenneth N. Raymond
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 5157 - 5161
• a: 46.011 ± 0.005 Å
• b: 57.883 ± 0.005 Å
• c: 19.405 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 51680 ± 9 ų
• Cell temperature: 177 ± 2 K
• Ambient diffraction temperature: 177 ± 2 K
• Number of distinct elements: 6
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.1658
• Residual factor for significantly intense reflections: 0.124
• Weighted residual factors for significantly intense reflections: 0.3199
• Weighted residual factors for all reflections included in the refinement: 0.3549
• Goodness-of-fit parameter for all reflections included in the refinement: 1.386
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No