Information card for entry 7115201

Structure parameters

• Formula: C12 H15 Ga5 N2 O24 P4
• Calculated formula: C12 H10 Ga5 N2 O24 P4
• Title of publication: Synthesis, crystal structure and 71Ga MAS NMR spectroscopy of a novel gallium phosphatooxalate: [Ga5(OH)2(C10H9N2)(C2O4)(PO4)4]·2H2O
• Authors of publication: Chen, Ching-Yeh; Chu, Peter P.; Lii, Kwang-Hwa; Lii, Kwang-Hwa
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 16
• Pages of publication: 1473
• a: 18.343 ± 0.0002 Å
• b: 15.9372 ± 0.0004 Å
• c: 9.1019 ± 0.0002 Å
• α: 90°
• β: 90.867 ± 0.001°
• γ: 90°
• Cell volume: 2660.51 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0682
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No