Information card for entry 7018118

Structure parameters

• Formula: C24 H24 F2 N8 O10 P2 Zn2
• Calculated formula: C24 H24 F2 N8 O10 P2 Zn2
• SMILES: c1cccc2[n]1[Zn]13([n]4c(cccc4)C=[N]1O)(OP(=O)(F)O[Zn]14([n]5ccccc5C=[N]1O)([n]1ccccc1C=[N]4O)OP(=O)(F)O3)[N](=C2)O
• Title of publication: Metal ion-assisted transformations of 2-pyridinealdoxime and hexafluorophosphate.
• Authors of publication: Konidaris, Konstantis F.; Polyzou, Christina D.; Kostakis, George E.; Tasiopoulos, Anastasios J.; Roubeau, Olivier; Teat, Simon J.; Manessi-Zoupa, Evy; Powell, Annie K.; Perlepes, Spyros P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 10
• Pages of publication: 2862 - 2865
• a: 9.1885 ± 0.0003 Å
• b: 12.1035 ± 0.0005 Å
• c: 13.9159 ± 0.0005 Å
• α: 90°
• β: 90.663 ± 0.003°
• γ: 90°
• Cell volume: 1547.53 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0279
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.0569
• Weighted residual factors for all reflections included in the refinement: 0.0582
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No