Information card for entry 2012984

Structure parameters

• Common name: 01023a
• Chemical name: poly[[[bis(2-methoxyethyl) ether]lithium(I)]-di-μ~3~-trifluoromethanesulfonato-lithium(I)]
• Formula: C8 H14 F6 Li2 O9 S2
• Calculated formula: C8 H14 F6 Li2 O9 S2
• SMILES: [Li]123([O](C)CC[O]1CC[O]2C)[O]=S1(C(F)(F)F)=[O][Li]24[O]=S(C(F)(F)F)(=[O][Li](O1)[O]=S(O3)(=O)C(F)(F)F)O[Li]13([O](C)CC[O]1CC[O]3C)[O]=S(O2)(C(F)(F)F)=[O][Li]12OS(C(F)(F)F)(=[O][Li]35([O](C)CC[O]3CC[O]5C)[O]=S(O1)(=[O]4)C(F)(F)F)=[O][Li]1[O]=S(C(F)(F)F)(=[O]2)O[Li]23([O](C)CC[O]2CC[O]3C)OS(=[O]1)(=O)C(F)(F)F
• Title of publication: Li^+^ cation coordination in [Li~2~(CF~3~SO~3~)~2~(diglyme)] and [Li~3~(C~2~F~3~O~2~)~3~(diglyme)]
• Authors of publication: Henderson, Wesley A.; Young, Victor G. Jr; Brooks, Neil R.; Smyrl, William H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 10
• Pages of publication: m501 - m503
• a: 8.678 ± 0.003 Å
• b: 10.815 ± 0.003 Å
• c: 11.899 ± 0.004 Å
• α: 67.566 ± 0.005°
• β: 89.831 ± 0.005°
• γ: 71.435 ± 0.005°
• Cell volume: 969.5 ± 0.5 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: 0.054
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes