Information card for entry 7208699

Structure parameters

• Formula: C14 H8 Li2 O5
• Calculated formula: C14 H8 Li2 O5
• SMILES: C(=O)(c1ccc(cc1)Oc1ccc(C(=O)[O-])cc1)[O-].[Li+].[Li+]
• Title of publication: Synthesis, structures, and properties of alkali and alkaline earth coordination polymers based on V-shaped ligand
• Authors of publication: Cheng, P.-C.; Tseng, F.-S.; Yeh, C.-T.; Chang, T.-G.; Kao, C.-C.; Lin, C.-H.; Liu, W.-R.; Chen, J.-S.; Zima, V.
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 20
• Pages of publication: 6812
• a: 8.4363 ± 0.0004 Å
• b: 5.3754 ± 0.0002 Å
• c: 25.8792 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1173.58 ± 0.09 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0618
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0819
• Weighted residual factors for all reflections included in the refinement: 0.0884
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No