Information card for entry 7125513

Structure parameters

• Formula: C5 H21 N3 O16 P4 Zn3
• Calculated formula: C5 H21 N3 O16 P4 Zn3
• Title of publication: A new route for the synthesis of open-framework metal phosphates using organophosphates
• Authors of publication: Neeraj, S.; Forster, P. M.; Rao, C. N. R.; Cheetham, A. K.
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 24
• Pages of publication: 2716
• a: 8.4408 ± 0.0013 Å
• b: 9.263 ± 0.0016 Å
• c: 13.843 ± 0.002 Å
• α: 81.119 ± 0.015°
• β: 83.643 ± 0.012°
• γ: 72.647 ± 0.011°
• Cell volume: 1018.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0425
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.106
• Weighted residual factors for all reflections included in the refinement: 0.1131
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No