Information card for entry 1560998

Structure parameters

• Formula: C16 H20 Li2 O10
• Calculated formula: C16 H20 Li2 O10
• SMILES: C(=O)(COc1ccc(c2ccc(cc2)OCC(=O)[O-])cc1)[O-].[Li+].O.O.[Li+].O.O
• Title of publication: Structural diversity of alkali metal coordination polymers driven by flexible biphenyl-4,4′-dioxydiacetic acid
• Authors of publication: Łyszczek, Renata; Głuchowska, Halina; Mazur, Liliana; Tarasiuk, Bogdan; Kinzhybalo, Vasyl; Kirillov, Alexander M.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2018
• Journal volume: 265
• Pages of publication: 92 - 99
• a: 16.997 ± 0.004 Å
• b: 7.901 ± 0.002 Å
• c: 6.549 ± 0.002 Å
• α: 90°
• β: 94.93 ± 0.03°
• γ: 90°
• Cell volume: 876.2 ± 0.4 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0565
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1374
• Weighted residual factors for all reflections included in the refinement: 0.1436
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No