Information card for entry 7113736

Structure parameters

• Formula: C70 H118 Cu2 F12 N8 O33 Pt4 S12
• Calculated formula: C69.998 H117 Cu2 F11.994 N8 O32.994 Pt4 S11.998
• Title of publication: The non-templated empty cavity and its selective anion binding despite having similar shapes
• Authors of publication: Kim, Kwan Mook; Kim, Ki-Hyun; Kang, Tae Yi; Park, Jung Su; Song, Rita; Jun, Moo-Jin
• Journal of publication: Chemical Communications
• Year of publication: 2003
• Journal issue: 12
• Pages of publication: 1410
• a: 30.6281 ± 0.0011 Å
• b: 19.8478 ± 0.0007 Å
• c: 21.0157 ± 0.0006 Å
• α: 90°
• β: 111.45 ± 0.002°
• γ: 90°
• Cell volume: 11890.6 ± 0.7 ų
• Cell temperature: 210 ± 2 K
• Ambient diffraction temperature: 210 ± 2 K
• Number of distinct elements: 8
• 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: 0.1104
• Residual factor for significantly intense reflections: 0.08
• Weighted residual factors for significantly intense reflections: 0.2065
• Weighted residual factors for all reflections included in the refinement: 0.2325
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7103708
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No