Information card for entry 7704041

Structure parameters

• Formula: C95 H101 Cl4 N15 O40 Pd3
• Calculated formula: C94.548 H99 Cl5 N14 O41 Pd3
• Title of publication: Diverse anion exchange of pliable [X₂@Pd₃L₄]⁴⁺ double cages: a molecular ruler for recognition of polyatomic anions.
• Authors of publication: Sarada, Ganguri; Kim, Ahreum; Kim, Dongwon; Jung, Ok-Sang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 19
• Pages of publication: 6183 - 6190
• a: 14.393 ± 0.003 Å
• b: 19.113 ± 0.004 Å
• c: 23.51 ± 0.005 Å
• α: 98.23 ± 0.03°
• β: 106.16 ± 0.03°
• γ: 90.4 ± 0.03°
• Cell volume: 6140 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1568
• Residual factor for significantly intense reflections: 0.1065
• Weighted residual factors for significantly intense reflections: 0.2957
• Weighted residual factors for all reflections included in the refinement: 0.3226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 0.8 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No