Information card for entry 7228191

Structure parameters

• Formula: C169 H138 Ag4 N8 O11 P8 Re4
• Calculated formula: C169 H138 Ag4 N8 O11 P8 Re4
• SMILES: [Re]1(C#[O])(C#[O])(C#[N][Ag][N]#C[Re](C#[O])(C#[O])(C#[N][Ag][N]#C[Re](C#[O])(C#[O])(C#[N][Ag][N]#C[Re](C#[O])(C#[O])(C#[N][Ag][N]#C1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.O=C(C)C.O=C(C)C.O=C(C)C
• Title of publication: On the Rhenium(I)‒Silver(I) Cyanide Porous Macrocyclic Clusters
• Authors of publication: Krawczyk, Monika K.; Bikas, Rahman; Krawczyk, Marta S.; Lis, Tadeusz
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 12.275 ± 0.002 Å
• b: 18.433 ± 0.005 Å
• c: 36.135 ± 0.009 Å
• α: 82.79 ± 0.03°
• β: 88.71 ± 0.03°
• γ: 72.06 ± 0.03°
• Cell volume: 7716 ± 3 ų
• Cell temperature: 80 ± 2 K
• Ambient diffraction temperature: 80 ± 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: 0.2192
• Residual factor for significantly intense reflections: 0.0925
• Weighted residual factors for significantly intense reflections: 0.1054
• Weighted residual factors for all reflections included in the refinement: 0.1376
• Goodness-of-fit parameter for all reflections included in the refinement: 0.918
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No