Information card for entry 8106380

Structure parameters

• Formula: C12 H15 La N8 O12
• Calculated formula: C12 H15 La N8 O12
• Title of publication: Crystal structure of diaqua-(N-(1-(pyrazin-2-yl)ethylidene)pyridin-1-ium-4-carbohydrazonate-κ3 N,N′,O)-tris[nitrato-κ2 O,O′)lanthanum(III), C12H15N8O12La
• Authors of publication: Jinli, Liu; Peiling, Zhang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 6
• Pages of publication: 1011 - 1012
• a: 8.3267 ± 0.0007 Å
• b: 28.348 ± 0.002 Å
• c: 9.1097 ± 0.0008 Å
• α: 90°
• β: 107.541 ± 0.001°
• γ: 90°
• Cell volume: 2050.3 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0283
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0536
• Weighted residual factors for all reflections included in the refinement: 0.0559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No