Information card for entry 7223758

Structure parameters

• Chemical name: 1,5-Dihydroxyanthraquinone dilithium hydrate
• Formula: C7 H5 Li O3
• Calculated formula: C7 H5 Li O3
• Title of publication: Coordination environments and π-conjugation in dense lithium coordination polymers
• Authors of publication: Tominaka, Satoshi; Yeung, Hamish H.-M.; Henke, Sebastian; Cheetham, Anthony K.
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 3
• Pages of publication: 398
• a: 8.0719 ± 0.0003 Å
• b: 5.1821 ± 0.0002 Å
• c: 14.8188 ± 0.0005 Å
• α: 90°
• β: 94.926 ± 0.003°
• γ: 90°
• Cell volume: 617.57 ± 0.04 ų
• Cell temperature: 302 K
• Ambient diffraction temperature: 302 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: 0.0368
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1017
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No