Information card for entry 6000489

Structure parameters

• Formula: C3 H14 N2 O12 P3 Zn2
• Calculated formula: C3 H14 N2 O12 P3 Zn2
• Title of publication: Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine
• Authors of publication: Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 4295 - 4304
• a: 7.5151 ± 0.0006 Å
• b: 8.2553 ± 0.0007 Å
• c: 12.9115 ± 0.0011 Å
• α: 98.654 ± 0.001°
• β: 101.274 ± 0.002°
• γ: 115.791 ± 0.001°
• Cell volume: 681.69 ± 0.1 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: 0.0405
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for all reflections: 0.1017
• Weighted residual factors for significantly intense reflections: 0.0928
• Goodness-of-fit parameter for all reflections: 1.047
• Goodness-of-fit parameter for significantly intense reflections: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No