Information card for entry 7231262

Structure parameters

• Formula: C8.05 H9.44 Li0.67 N0.67 O2.72
• Calculated formula: C8.06 H9.45333 Li0.666667 N0.666667 O2.72667
• Title of publication: Hygroscopicity of lithium coordination polymers and their solid solutions
• Authors of publication: Lestari, Monica; Lusi, Matteo; O'Leary, Aoife; O'Nolan, Daniel; Zaworotko, Michael J.
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 39
• Pages of publication: 5940
• a: 10.0666 ± 0.0009 Å
• b: 10.5869 ± 0.0008 Å
• c: 11.7836 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1255.83 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0497
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.1293
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No