Information card for entry 7704039

Structure parameters

• Formula: C112 H128 Cl4 N14 O42 Pd3 S4
• Calculated formula: C112 H128 Cl4 N14 O42 Pd3 S4
• 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: 14.016 ± 0.005 Å
• b: 16.03 ± 0.006 Å
• c: 18.468 ± 0.007 Å
• α: 66.969 ± 0.002°
• β: 86.217 ± 0.003°
• γ: 70.922 ± 0.003°
• Cell volume: 3600 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2143
• Residual factor for significantly intense reflections: 0.0746
• Weighted residual factors for significantly intense reflections: 0.1364
• Weighted residual factors for all reflections included in the refinement: 0.1824
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No