Information card for entry 7231264

Structure parameters

• Formula: C12 H14 Li N O4
• Calculated formula: C12 H14 Li N O4
• 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: 10.0679 ± 0.0005 Å
• b: 10.5702 ± 0.0006 Å
• c: 11.7537 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1250.83 ± 0.12 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: 0.0476
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1234
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No