Information card for entry 2239603

Structure parameters

• Chemical name: <i>catena</i>-Poly[[lithium-μ~2~-(dihydrogen pyrazine-2,3,5,6-tetracarboxylato)-κ^6^<i>O</i>^2^,<i>N</i>^1^,<i>O</i>^6^;<i>O</i>^3^,<i>N</i>^4^,<i>O</i>^5^-lithium-di-μ-aqua-κ^4^<i>O</i>:<i>O</i>] 2.5-hydrate]
• Formula: C8 H11 Li2 N2 O12.5
• Calculated formula: C8 H11 Li2 N2 O12.5
• Title of publication: <i>catena</i>-Poly[[lithium-μ~2~-(dihydrogen pyrazine-2,3,5,6-tetracarboxylato)-κ^6^<i>O</i>^2^,<i>N</i>^1^,<i>O</i>^6^;<i>O</i>^3^,<i>N</i>^4^,<i>O</i>^5^-lithium-di-μ-aqua-κ^4^<i>O</i>:<i>O</i>] 2.5-hydrate]
• Authors of publication: Starosta, Wojciech; Leciejewicz, Janusz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 6
• Pages of publication: m234 - m235
• a: 12.0554 ± 0.0003 Å
• b: 6.3904 ± 0.00017 Å
• c: 19.3383 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1489.8 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0477
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1172
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes