Information card for entry 7127948

Structure parameters

• Formula: C142 H176 F18 N18 O24 Pd4 S6 Si8
• Calculated formula: C142 H176 F18 N18 O24 Pd4 S6 Si8
• Title of publication: A cyclic manipulation of cage isomers <i>via</i> anion exchange and thermal isomerism.
• Authors of publication: Park, Seonghyeon; Kim, Dongwon; Kim, Doheon; Kim, Dongwook; Jung, Ok-Sang
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 23
• Pages of publication: 2919 - 2922
• a: 18.072 ± 0.004 Å
• b: 18.561 ± 0.004 Å
• c: 18.661 ± 0.004 Å
• α: 117.75 ± 0.03°
• β: 116.05 ± 0.03°
• γ: 91.67 ± 0.03°
• Cell volume: 4757 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.075
• Residual factor for significantly intense reflections: 0.0674
• Weighted residual factors for significantly intense reflections: 0.1953
• Weighted residual factors for all reflections included in the refinement: 0.1998
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.65 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No