Information card for entry 7023132

Structure parameters

• Chemical name: catena-poly[diaquabis-μ-{N, N'-bis(3-pyridyl)ethanediamido} copper (II) hexaflurophosphate]
• Formula: C28 H32 Cu F12 N8 O6 P2
• Calculated formula: C28 H32 Cu F12 N8 O6 P2
• Title of publication: Cooperative effect of "flexible" interaction and "flexible" framework in reversible intake and removal of aromatic guest molecules.
• Authors of publication: Suman, Kumari; Rajnikant,; Gupta, Vivek K.; Sarkar, Madhushree
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 23
• Pages of publication: 8492 - 8497
• a: 8.8145 ± 0.0003 Å
• b: 9.5878 ± 0.0003 Å
• c: 11.3029 ± 0.0003 Å
• α: 82.786 ± 0.002°
• β: 70.994 ± 0.003°
• γ: 86.46 ± 0.002°
• Cell volume: 895.78 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.043
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No