Information card for entry 7101655

Structure parameters

• Formula: C175.2 H200.4 N10 O11.4 Sn2
• Calculated formula: C175.2 H200.4 N10 O11.4 Sn2
• Title of publication: Cavity effect amplification in the recognition of dicarboxylic acids by initial ditopic H-bond formation followed by kinetic trapping.
• Authors of publication: Brotherhood, Peter R; Wu, Richard A-S; Turner, Peter; Crossley, Maxwell J
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 3
• Pages of publication: 225 - 227
• a: 31.236 ± 0.005 Å
• b: 27.384 ± 0.007 Å
• c: 21.366 ± 0.005 Å
• α: 90°
• β: 115.594 ± 0.01°
• γ: 90°
• Cell volume: 16482 ± 6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0505
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.1138
• Weighted residual factors for all reflections included in the refinement: 0.1177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.273
• Diffraction radiation wavelength: 0.56356 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No