Information card for entry 1507492

Structure parameters

• Formula: C38 H72 F18 Li6 O34 S6
• Calculated formula: C38 H72 F18 Li6 O34 S6
• Title of publication: Crystalline Phases of Poly(Ethylene Oxide) Oligomers and Sodium Triflate: Changes in Coordination and Conformation with Chain Length
• Authors of publication: Rhodes, Christopher P.; Khan, Masood; Frech, Roger
• Journal of publication: The Journal of Physical Chemistry B
• Year of publication: 2002
• Journal volume: 106
• Journal issue: 40
• Pages of publication: 10330
• a: 13.11 ± 0.003 Å
• b: 16.496 ± 0.004 Å
• c: 19.382 ± 0.003 Å
• α: 104.55 ± 0.015°
• β: 100.628 ± 0.016°
• γ: 111.661 ± 0.015°
• Cell volume: 3587.2 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1135
• Residual factor for significantly intense reflections: 0.0738
• Weighted residual factors for significantly intense reflections: 0.1791
• Weighted residual factors for all reflections included in the refinement: 0.2067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No