Information card for entry 7124098

Structure parameters

• Common name: NaPtMe10CB[5]
• Formula: C40 H50 Cl6 N20 Na2 O13 Pt
• Calculated formula: C40 H50 Cl6 N20 Na2 O13 Pt
• SMILES: C1N2C(=[O][Na]3456)N7CN8C(=[O]3)N3CN9C(=[O]4)N4CN%10C%11(C%12(C)N%13C(=[O][Na]%14%15%16%17)N%11CN%11C(=[O]%14)N(C%14(C)C4%11C)CN%14C3(C)C3(N(CN3C7(C)C3(C)N(CN3C(=[O]%15)N(C%13)C3(C2(C)N1C(=[O]5)N3CN%12C%10=[O]6)C)C8=[O]%16)C9=[O]%17)C)C.[Cl-][Pt](Cl)(Cl)(Cl)(Cl)[Cl-].O.O.O
• Title of publication: Decamethylcucurbit[5]uril based Supramolecular Assemblies as Efficient Electrocatalysts for Oxygen Reduction Reaction
• Authors of publication: Chen, Ruru; Cao, Minna; Wang, Jin-Yun; Li, Hongfang; Cao, Rong
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 11.076 ± 0.0001 Å
• b: 15.1322 ± 0.0002 Å
• c: 15.9211 ± 0.0002 Å
• α: 90°
• β: 92.659 ± 0.001°
• γ: 90°
• Cell volume: 2665.57 ± 0.05 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0487
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No