Information card for entry 4503744

Structure parameters

• Formula: C21 H33 N3 O12 P2 Zn2
• Calculated formula: C21 H31 N3 O12 P2 Zn2
• Title of publication: Mixed-Solvothermal Syntheses and Structures of Six New Zinc Phosphonocarboxylates with Zeolite-type and Pillar-Layered Frameworks
• Authors of publication: Chen, Zhenxia; Zhou, Yaming; Weng, Linhong; Zhao, Dongyuan
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 11
• Pages of publication: 4045
• a: 10.075 ± 0.009 Å
• b: 13.051 ± 0.007 Å
• c: 13.24 ± 0.009 Å
• α: 70.79 ± 0.04°
• β: 68.85 ± 0.04°
• γ: 70.61 ± 0.04°
• Cell volume: 1487.6 ± 1.9 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: 0.0839
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.189
• Weighted residual factors for all reflections included in the refinement: 0.1995
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No