Information card for entry 6000500

Structure parameters

• Formula: C12 H36 Ga4 N4 O30 P6
• Calculated formula: C12 Ga4 N4 O30 P6
• Title of publication: Synthesis and characterization of (R-C5H14N2)(2)[Ga-4(C2O4)(H2PO4)(2)(PO4)(4)].2H(2)O, a layered gallium phosphatooxalate containing a chiral amine
• Authors of publication: Kwang-Hwa Lii; Ching-Yeh Chen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 3374 - 3378
• a: 8.0248 ± 0.0004 Å
• b: 25.9554 ± 0.0014 Å
• c: 9.0127 ± 0.0005 Å
• α: 90°
• β: 100.151 ± 0.001°
• γ: 90°
• Cell volume: 1847.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0382
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for all reflections: 0.098
• Weighted residual factors for significantly intense reflections: 0.0957
• Goodness-of-fit parameter for all reflections: 1.031
• Goodness-of-fit parameter for significantly intense reflections: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No