Information card for entry 7223769

Structure parameters

• Chemical name: Lithium formate anhydrous
• Formula: C H Li O2
• Calculated formula: C H Li O2
• SMILES: [Li+].[O-]C=O
• 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: 12.0519 ± 0.0003 Å
• b: 12.0497 ± 0.0003 Å
• c: 13.5108 ± 0.0003 Å
• α: 90°
• β: 101.003 ± 0.003°
• γ: 90°
• Cell volume: 1925.99 ± 0.08 ų
• Cell temperature: 300 ± 0.14 K
• Ambient diffraction temperature: 300 ± 0.14 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0383
• Residual factor for significantly intense reflections: 0.0293
• Weighted residual factors for significantly intense reflections: 0.0789
• Weighted residual factors for all reflections included in the refinement: 0.0843
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No