Information card for entry 2200428

Structure parameters

• Chemical name: di-μ-iodo-bis(1,4,7,10,13,16-hexaoxacyclooctadecanecaesium(I)) p-xylene solvate
• Formula: C32 H58 Cs2 I2 O12
• Calculated formula: C32 H58 Cs2 I2 O12
• Title of publication: The sandwich dimeric form of a Cs^I^ complex of 18-crown-6 with bridging iodide ions
• Authors of publication: Kim, Tae Ho; Park, Ki-Min; Lee, Shim Sung; Kim, Jae Sang; Kim, Jineun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 8
• Pages of publication: m357 - m358
• a: 15.436 ± 0.001 Å
• b: 17.4317 ± 0.0011 Å
• c: 8.1756 ± 0.0005 Å
• α: 90°
• β: 91.195 ± 0.001°
• γ: 90°
• Cell volume: 2199.4 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for all reflections included in the refinement: 0.0753
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes