Information card for entry 8102272

Structure parameters

• Formula: C12 H14 Gd N3 O10
• Calculated formula: C12 H14 Gd N3 O10
• Title of publication: Crystal structure of diaqua-bis(2-bipyridinecarboxylato)gadolinium(III) nitrate monohydrate, [Gd(C6H4O2N)2(H2O)2][NO3] · H2O
• Authors of publication: Qiu-Yue Lin; Xin-Qian He; Yi-Han Wen
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 2
• Pages of publication: 181
• a: 9.3141 ± 0.0003 Å
• b: 7.6933 ± 0.0002 Å
• c: 23.5516 ± 0.0006 Å
• α: 90°
• β: 91.09 ± 0.001°
• γ: 90°
• Cell volume: 1687.31 ± 0.08 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: 0.0223
• Residual factor for significantly intense reflections: 0.0194
• Weighted residual factors for significantly intense reflections: 0.0469
• Weighted residual factors for all reflections included in the refinement: 0.0483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No