Information card for entry 1004033

Structure parameters

• Formula: C6 H18 N2 O12 P3 Zn2
• Calculated formula: C6 H18 N2 O12 P3 Zn2
• Title of publication: Hydrothermal synthesis and characterization of new phosphate-based materials prepared in the presence of 1,4-dimethylpiperazine
• Authors of publication: Josien, L.; Simon-Masseron, A.; Fleith, S.; Gramlich, V.; Patarin, J.
• Journal of publication: Impact of Zeolites and other Porous Materials on the new Technologies at the Beginning of the New Millennium Proceedings of the 2nd International FEZA (Federation of the European Zeolite Associations) Conference
• Year of publication: 2002
• Journal volume: 142
• Pages of publication: 415 - 422
• a: 8.641 ± 0.005 Å
• b: 14.364 ± 0.009 Å
• c: 12.581 ± 0.011 Å
• α: 90°
• β: 96.39 ± 0.06°
• γ: 90°
• Cell volume: 1551.8 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for all reflections: 0.0732
• Weighted residual factors for significantly intense reflections: 0.072
• Goodness-of-fit parameter for all reflections: 0.836
• Goodness-of-fit parameter for significantly intense reflections: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No