Information card for entry 2101511

Structure parameters

• Formula: C4 H8 N O10 Ti
• Calculated formula: C4 H8 N O10 Ti
• Title of publication: Charge density studies in NH~4~[Ti(C~2~O~4~)~2~].2H~2~O crystals at two wavelengths
• Authors of publication: Sheu, H. S.; Wu, J. C.; Wang, Y.; English, R. B.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 458 - 464
• a: 8.947 ± 0.002 Å
• b: 8.947 ± 0.002 Å
• c: 10.898 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 755.5 ± 0.2 ų
• Cell temperature: 298 K
• Number of distinct elements: 5
• Space group number: 181
• Hermann-Mauguin space group symbol: P 64 2 2
• Hall space group symbol: P 64 2 (0 0 2)
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.03
• Goodness-of-fit parameter for significantly intense reflections: 1.86
• Diffraction radiation wavelength: 0.5609 Å
• Diffraction radiation type: AgKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No